data_2l1b_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 2l1b _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 ' 3' ' ' GLN . . . . . 0.426 ' HB3' ' HE2' ' A' ' 5' ' ' PHE . 1.3 mp0 . . . . . 0 CA--C 1.543 0.7 0 CA-C-O 121.211 0.529 . . . . 0.0 109.593 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 71.3 t -82.51 120.8 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 109.622 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.426 ' HE2' ' HB3' ' A' ' 3' ' ' GLN . 86.8 m-85 -137.14 161.91 34.85 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.736 0.814 . . . . 0.0 109.676 178.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.89 129.87 37.64 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 174.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.413 HG12 HD12 ' A' ' 47' ' ' LEU . 2.7 p -111.25 143.11 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.507 1.123 . . . . 0.0 110.418 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.0 -58.99 2.96 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.468 1.107 . . . . 0.0 109.378 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.9 p -174.14 -172.28 0.69 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.402 1.081 . . . . 0.0 109.775 -176.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 22' ' ' TYR . 48.2 mm -98.01 120.07 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.49 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -73.68 -53.93 9.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.127 0.971 . . . . 0.0 109.552 179.812 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.445 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 99.0 mttt -138.05 174.45 10.55 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.916 0.886 . . . . 0.0 111.342 -176.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -154.55 144.79 21.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.35 1.06 . . . . 0.0 108.724 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -161.45 -179.2 7.16 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.984 0.914 . . . . 0.0 109.538 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 41.2 t -135.14 118.76 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -136.83 129.85 30.95 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.333 1.053 . . . . 0.0 109.274 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm 62.68 24.92 14.84 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.994 0.918 . . . . 0.0 111.63 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.04 -8.44 60.42 Favored Glycine 0 C--N 1.352 1.424 0 CA-C-N 115.816 -0.629 . . . . 0.0 113.232 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -85.87 117.99 25.07 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 123.84 0.856 . . . . 0.0 108.935 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.7 t -79.09 104.8 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -97.68 139.08 34.11 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.946 0.898 . . . . 0.0 110.139 -170.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.42 ' HB3' HD12 ' A' ' 10' ' ' ILE . 15.1 m-85 -118.13 121.3 40.18 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.0 tp -74.8 94.64 2.79 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 172.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.8 t -76.69 105.98 6.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.622 0.769 . . . . 0.0 109.97 -174.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.49 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.0 tptp -81.65 106.92 13.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.598 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 77.4 m95 -77.16 149.97 35.56 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.571 0.748 . . . . 0.0 110.787 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -77.44 -34.06 54.63 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.076 0.55 . . . . 0.0 111.322 -174.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.51 15.31 42.13 Favored Glycine 0 C--N 1.343 0.944 0 CA-C-N 116.229 -0.442 . . . . 0.0 113.008 -178.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.598 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 88.8 m95 -133.48 136.83 27.69 Favored Pre-proline 0 C--O 1.246 0.887 0 C-N-CA 123.125 0.57 . . . . 0.0 110.067 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.415 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 88.4 Cg_exo -52.21 158.05 5.72 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 123.355 2.704 . . . . 0.0 113.333 167.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.42 5.54 1.53 Allowed 'Trans proline' 0 C--N 1.377 2.049 0 C-N-CA 123.406 2.737 . . . . 0.0 114.603 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.415 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.0 pttt -90.03 -15.88 30.91 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.779 0.431 . . . . 0.0 110.923 170.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.408 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 97.7 m-85 -96.32 -2.6 45.47 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.54 0.736 . . . . 0.0 111.441 174.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -63.53 122.52 16.49 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.069 0.547 . . . . 0.0 110.727 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.41 ' HG1' ' HG2' ' A' ' 37' ' ' GLU . 13.8 p -102.43 135.91 43.21 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.74 0.816 . . . . 0.0 111.366 -172.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -76.33 75.37 3.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.276 0.63 . . . . 0.0 109.494 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.41 ' HG2' ' HG1' ' A' ' 35' ' ' THR . 66.4 mm-40 -90.65 117.95 68.33 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.19 169.16 15.78 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 121.996 1.797 . . . . 0.0 111.756 173.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -50.11 -39.41 42.78 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.985 1.314 . . . . 0.0 114.378 -171.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.78 -1.47 54.33 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -115.72 14.19 16.35 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.881 0.873 . . . . 0.0 111.236 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 28.9 mm -103.42 150.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 126.11 1.764 . . . . 0.0 109.541 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.443 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 5.6 tt -89.44 -79.47 0.33 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -80.66 126.63 77.71 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -80.45 -13.7 12.07 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.755 2.304 . . . . 0.0 114.247 -175.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -15.11 62.74 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.387 0.675 . . . . 0.0 112.74 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.413 HD12 HG12 ' A' ' 7' ' ' VAL . 3.9 mm? -58.42 -53.27 60.19 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 118.335 0.516 . . . . 0.0 111.715 178.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.14 -32.53 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.876 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.488 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmt -62.4 -52.34 63.97 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 175.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.25 72.24 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.494 1.118 . . . . 0.0 111.58 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -62.82 -47.37 83.71 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.206 1.003 . . . . 0.0 110.928 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.34 -9.9 59.29 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 49' ' ' MET . 27.3 mm-40 . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 120.942 0.401 . . . . 0.0 110.447 169.938 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.0 mptt . . . . . 0 C--O 1.238 0.476 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -130.15 127.4 39.67 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.076 0.951 . . . . 0.0 108.824 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.91 -174.0 2.36 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . 0.443 ' HG2' ' HB2' ' A' ' 43' ' ' LEU . 9.7 ptp180 . . . . . 0 N--CA 1.47 0.558 0 C-N-CA 123.47 0.708 . . . . 0.0 109.837 -176.162 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 . . . . . 0 CA--C 1.541 0.611 0 CA-C-O 121.133 0.492 . . . . 0.0 109.686 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 t -109.68 144.32 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 124.273 1.029 . . . . 0.0 108.612 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.538 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 72.8 m-85 -128.97 160.73 31.77 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 167.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.48 114.13 10.27 Favored 'General case' 0 C--O 1.242 0.673 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 166.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.408 HG12 ' O ' ' B' ' 23' ' ' LYS . 3.1 p -92.95 137.88 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.083 0.553 . . . . 0.0 111.331 -172.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.644 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.8 tt0 -63.12 -59.56 4.61 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.714 0.806 . . . . 0.0 109.496 174.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.3 p -176.73 176.53 1.5 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-N 113.621 -1.627 . . . . 0.0 108.844 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.495 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.4 mm -82.95 115.6 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -53.56 18.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.184 0.594 . . . . 0.0 110.279 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -133.96 166.32 22.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.565 0.746 . . . . 0.0 110.566 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -151.06 142.2 23.15 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -154.42 173.23 16.52 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.447 0.699 . . . . 0.0 109.318 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.03 125.03 9.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.3 ptt180 -139.9 122.22 15.99 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.651 0.78 . . . . 0.0 109.296 178.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 62.62 26.45 15.68 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.853 1.261 . . . . 0.0 110.667 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.46 -8.01 80.49 Favored Glycine 0 C--N 1.354 1.543 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.712 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 70.2 mmtt -89.77 112.96 24.42 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 117.252 0.526 . . . . 0.0 110.858 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.2 t -89.36 108.33 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.37 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 51.4 mt-10 -96.76 155.73 16.65 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.243 0.617 . . . . 0.0 110.738 -177.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.495 ' HB3' HD12 ' A' ' 10' ' ' ILE . 66.2 m-85 -132.99 112.22 11.66 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.142 0.977 . . . . 0.0 108.693 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.26 90.58 0.5 Allowed 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.26 106.91 4.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.521 0.728 . . . . 0.0 111.305 -173.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -82.8 107.25 15.29 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.538 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 52.9 m95 -71.45 149.25 46.06 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.853 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.644 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 26.7 ttpp -67.48 -65.43 0.69 Allowed 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.319 0.648 . . . . 0.0 112.614 -166.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.21 41.07 2.72 Favored Glycine 0 N--CA 1.467 0.763 0 CA-C-N 116.583 -0.28 . . . . 0.0 112.759 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.502 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.7 m95 -139.57 133.97 16.03 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 123.715 0.806 . . . . 0.0 109.385 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -59.71 157.31 33.22 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 122.775 2.317 . . . . 0.0 112.374 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.55 -15.23 19.32 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 124.046 3.164 . . . . 0.0 115.328 -172.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.52 -25.19 67.88 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -87.39 -5.1 59.0 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.463 0.705 . . . . 0.0 112.619 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.1 p -66.6 125.83 27.0 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.462 ' HG1' ' HG2' ' A' ' 37' ' ' GLU . 21.4 p -118.36 135.91 54.05 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.692 0.797 . . . . 0.0 110.904 -173.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -68.81 85.4 0.32 Allowed 'General case' 0 C--N 1.356 0.874 0 C-N-CA 123.276 0.63 . . . . 0.0 109.389 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HG2' ' HG1' ' A' ' 35' ' ' THR . 45.9 mm-40 -100.64 102.83 20.63 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.438 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 41.0 Cg_endo -62.91 178.92 0.86 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 122.513 2.142 . . . . 0.0 113.234 173.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -59.13 -24.19 62.79 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.8 mp0 -73.84 -23.18 59.6 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.175 0.59 . . . . 0.0 111.979 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -94.56 -19.27 20.65 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -168.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.43 HG22 ' HA ' ' B' ' 25' ' ' ALA . 33.2 mm -90.81 149.36 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.76 0.824 . . . . 0.0 110.613 -174.17 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -86.34 -71.94 0.52 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.214 0.606 . . . . 0.0 109.617 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -72.03 126.68 91.2 Favored Pre-proline 0 CA--C 1.562 1.407 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -76.43 -23.23 11.71 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.575 2.183 . . . . 0.0 113.796 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -69.87 -12.83 61.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.33 1.052 . . . . 0.0 113.59 -168.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.436 ' HB3' HG12 ' A' ' 10' ' ' ILE . 3.0 mm? -57.31 -40.63 78.26 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 118.116 0.416 . . . . 0.0 110.693 171.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.63 -43.95 93.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.059 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.422 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 1.5 mpt? -61.95 -50.58 71.56 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.589 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.32 -34.97 74.55 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.283 1.033 . . . . 0.0 111.797 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.34 -39.69 94.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.039 0.936 . . . . 0.0 110.926 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -87.15 -10.68 52.1 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.735 0.814 . . . . 0.0 111.942 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 49' ' ' MET . 41.0 mm-40 . . . . . 0 N--CA 1.482 1.17 0 C-N-CA 122.856 0.463 . . . . 0.0 110.785 175.025 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . 0.408 ' O ' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.97 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 . . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -102.03 104.3 14.95 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.164 0.506 . . . . 0.0 110.647 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.43 ' HA ' HG22 ' A' ' 42' ' ' ILE . . . -103.85 142.34 34.57 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 164.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 . . . . . 0 N--CA 1.469 0.505 0 C-N-CA 123.104 0.561 . . . . 0.0 110.092 -172.537 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 121.219 0.533 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 46.0 t -83.65 125.01 40.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.482 1.113 . . . . 0.0 109.512 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -133.44 147.01 51.68 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.937 0.495 . . . . 0.0 110.421 176.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.66 111.32 4.73 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.1 p -89.37 144.14 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.685 0.794 . . . . 0.0 110.736 -176.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -81.92 -61.19 1.99 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.739 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.6 m -158.35 171.58 19.91 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.937 0.895 . . . . 0.0 110.221 -174.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.47 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 34.7 mm -92.81 117.5 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 163.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.01 -46.91 27.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.944 0.898 . . . . 0.0 109.887 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -151.65 166.1 32.3 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.532 0.733 . . . . 0.0 109.765 -176.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -146.97 152.21 38.26 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.242 1.017 . . . . 0.0 109.68 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -165.15 167.69 17.91 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.367 1.467 . . . . 0.0 108.526 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.443 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 13.6 p -118.42 145.35 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 172.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -142.81 96.02 2.87 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.178 0.591 . . . . 0.0 109.602 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm 55.96 39.19 30.58 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.546 1.138 . . . . 0.0 111.554 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.48 -19.51 52.2 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.752 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -85.75 108.29 18.01 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.443 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 11.3 t -85.9 109.77 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -175.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -93.82 136.53 34.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.896 0.878 . . . . 0.0 109.657 -170.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -124.48 122.79 38.61 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -71.63 85.87 0.89 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 170.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.592 HG23 HD12 ' A' ' 42' ' ' ILE . 65.8 t -77.43 107.03 8.35 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.741 -173.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -74.54 102.84 4.65 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.598 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.7 m95 -74.18 138.0 43.49 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.498 177.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -77.95 -17.9 56.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.008 0.523 . . . . 0.0 111.35 -172.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.37 13.76 28.08 Favored Glycine 0 C--N 1.346 1.116 0 C-N-CA 123.107 0.384 . . . . 0.0 112.994 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.598 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.2 m95 -130.88 147.16 65.14 Favored Pre-proline 0 N--CA 1.482 1.173 0 C-N-CA 123.592 0.757 . . . . 0.0 110.537 178.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -55.13 157.26 14.12 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.212 2.608 . . . . 0.0 113.254 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -63.92 -16.74 56.6 Favored 'Trans proline' 0 C--N 1.384 2.409 0 C-N-CA 123.122 2.548 . . . . 0.0 113.338 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.67 -27.94 30.98 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.009 0.524 . . . . 0.0 111.465 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -86.76 -1.43 57.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.628 0.771 . . . . 0.0 111.174 175.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.6 m -67.11 117.99 9.91 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 170.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.0 p -106.58 151.66 24.73 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.361 0.664 . . . . 0.0 111.269 -172.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -79.19 89.28 4.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.281 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -100.45 119.1 59.76 Favored Pre-proline 0 C--O 1.239 0.53 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.41 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 61.0 Cg_endo -69.46 171.23 14.5 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.296 1.998 . . . . 0.0 112.073 173.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -61.9 -19.45 62.68 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.654 0.782 . . . . 0.0 112.13 177.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -56.88 -46.59 81.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.993 0.917 . . . . 0.0 110.224 168.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.8 m170 -85.47 -25.23 27.03 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.666 -172.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.592 HD12 HG23 ' A' ' 24' ' ' VAL . 48.1 mm -81.84 146.21 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.599 0.76 . . . . 0.0 111.624 -174.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.1 mt -86.47 -61.92 1.63 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.678 0.791 . . . . 0.0 110.098 173.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -72.55 112.68 15.93 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 123.397 0.679 . . . . 0.0 110.161 -172.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.49 -24.49 7.59 Favored 'Trans proline' 0 C--N 1.374 1.873 0 C-N-CA 122.582 2.188 . . . . 0.0 112.582 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -72.89 -21.15 60.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.271 1.028 . . . . 0.0 109.71 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 44.5 tp -55.22 -48.64 73.6 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.354 1.461 . . . . 0.0 112.234 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t -68.92 -36.03 72.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.216 -177.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.405 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 92.6 mmm -55.86 -45.51 78.48 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.086 0.866 . . . . 0.0 110.666 178.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.58 -33.43 63.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.964 0.905 . . . . 0.0 112.454 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.47 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 86.1 t80 -75.44 -46.03 35.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.113 0.965 . . . . 0.0 110.389 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.53 -11.89 61.1 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.652 0.781 . . . . 0.0 112.899 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 49' ' ' MET . 11.0 mm-40 . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 121.323 0.582 . . . . 0.0 109.821 172.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtpt . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -119.91 113.09 20.03 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 122.897 0.479 . . . . 0.0 110.232 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.453 ' HB2' HD11 ' A' ' 42' ' ' ILE . . . -96.4 172.66 7.8 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 169.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 . . . . . 0 N--CA 1.467 0.386 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 -175.426 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 . . . . . 0 CA--C 1.551 1.018 0 CA-C-O 121.112 0.482 . . . . 0.0 112.174 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.9 t -102.15 121.36 53.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 125.022 1.329 . . . . 0.0 107.978 172.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.419 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 52.4 m-85 -127.13 155.09 43.89 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 118.065 0.393 . . . . 0.0 110.338 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.97 114.75 6.78 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.423 HG13 HD13 ' A' ' 47' ' ' LEU . 4.1 p -103.97 137.52 32.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 C-N-CA 124.116 0.967 . . . . 0.0 111.073 -173.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -74.87 -63.03 1.35 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.924 -177.554 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -165.48 -177.65 4.54 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.941 0.896 . . . . 0.0 110.385 -173.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.541 HD13 ' HB3' ' A' ' 22' ' ' TYR . 49.9 mm -86.95 109.68 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 169.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.63 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -68.76 -49.62 57.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.848 1.259 . . . . 0.0 109.408 -178.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -146.03 168.96 19.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.407 1.083 . . . . 0.0 109.788 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -155.18 138.73 15.97 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.969 0.908 . . . . 0.0 108.897 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -165.56 139.78 4.7 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.64 0.776 . . . . 0.0 109.714 174.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.97 118.63 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 CA-C-O 121.256 0.55 . . . . 0.0 110.625 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -107.53 101.3 10.64 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.022 0.929 . . . . 0.0 109.615 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 59.45 40.96 20.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.065 1.346 . . . . 0.0 112.642 174.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.81 -17.64 57.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-N 115.533 -0.758 . . . . 0.0 113.232 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -90.49 110.92 22.03 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.3 t -81.82 111.4 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -93.78 137.94 32.5 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 123.913 0.885 . . . . 0.0 109.474 -173.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.541 ' HB3' HD13 ' A' ' 10' ' ' ILE . 72.6 m-85 -121.61 114.73 21.59 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.507 HD21 ' HD2' ' A' ' 11' ' ' ARG . 23.6 tp -70.55 93.62 0.92 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 170.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 73.5 t -70.73 105.84 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 124.659 1.184 . . . . 0.0 110.571 -175.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.63 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 21.0 tptm -78.63 101.06 7.27 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 172.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.5 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 74.1 m95 -69.09 141.23 54.78 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 173.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -76.65 -39.56 51.86 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.95 -47.96 35.89 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.212 178.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.5 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.9 m95 -87.24 136.31 33.76 Favored Pre-proline 0 N--CA 1.479 0.994 0 C-N-CA 123.455 0.702 . . . . 0.0 110.491 -177.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -60.42 164.05 13.83 Favored 'Trans proline' 0 CA--C 1.569 2.262 0 C-N-CA 123.081 2.521 . . . . 0.0 112.034 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.53 -19.33 13.41 Favored 'Trans proline' 0 C--N 1.39 2.744 0 C-N-CA 124.059 3.173 . . . . 0.0 115.562 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -71.58 -27.51 63.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.634 0.374 . . . . 0.0 111.991 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.409 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 67.6 m-85 -97.19 12.39 33.0 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.425 0.69 . . . . 0.0 111.857 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -64.77 122.77 17.67 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 173.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.409 ' HG1' ' HG2' ' A' ' 37' ' ' GLU . 24.7 p -101.55 128.8 47.63 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.877 0.871 . . . . 0.0 111.005 -173.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -68.8 83.49 0.3 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 171.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.491 ' HB3' ' HB2' ' A' ' 41' ' ' HIS . 29.0 mm-40 -106.85 116.82 58.07 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.1 174.96 5.23 Favored 'Trans proline' 0 C--N 1.362 1.243 0 C-N-CA 122.064 1.843 . . . . 0.0 111.421 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -56.84 -19.07 15.44 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.495 1.118 . . . . 0.0 112.858 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.73 -22.89 62.68 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.127 1.371 . . . . 0.0 112.078 173.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . 0.491 ' HB2' ' HB3' ' A' ' 37' ' ' GLU . 66.8 m-70 -117.04 -16.47 10.48 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.149 0.98 . . . . 0.0 112.176 -174.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mm -82.26 140.92 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 122.905 0.482 . . . . 0.0 110.626 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.5 mt -87.91 -70.73 0.61 Allowed 'General case' 0 C--N 1.351 0.655 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -72.73 126.63 90.59 Favored Pre-proline 0 CA--C 1.557 1.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -80.13 -17.6 10.45 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.865 2.377 . . . . 0.0 113.828 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.634 ' HA ' ' HG2' ' A' ' 49' ' ' MET . 87.1 mtm180 -69.82 -16.38 63.26 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.247 0.619 . . . . 0.0 111.887 -173.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.423 HD13 HG13 ' A' ' 7' ' ' VAL . 4.3 mm? -58.02 -53.75 54.68 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.346 0.658 . . . . 0.0 110.457 172.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.7 t -70.69 -53.06 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 114.515 -1.221 . . . . 0.0 109.85 -171.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.634 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 25.6 ptm -59.18 -33.34 70.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.722 0.639 . . . . 0.0 112.086 -174.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.97 -49.56 74.24 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -66.13 -30.95 71.54 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.004 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -74.97 -18.88 60.31 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.788 0.835 . . . . 0.0 111.586 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 . . . . . 0 N--CA 1.476 0.826 0 C-N-CA 122.94 0.496 . . . . 0.0 111.544 173.666 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.243 0.76 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -127.55 123.8 36.68 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 111.297 -176.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.92 168.42 10.31 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 167.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 . . . . . 0 C--N 1.319 -0.754 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -176.007 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 47.9 t -133.85 128.24 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 167.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.407 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 63.6 m-85 -138.07 166.8 23.21 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.224 0.61 . . . . 0.0 109.84 175.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.92 151.38 44.76 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.42 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.446 HG12 HD11 ' A' ' 47' ' ' LEU . 2.5 p -138.49 133.41 42.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 C-N-CA 124.097 0.959 . . . . 0.0 109.479 -176.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -72.64 -50.5 24.77 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.91 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 p -174.25 175.36 2.68 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 124.336 1.054 . . . . 0.0 110.047 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.533 HD13 ' HB3' ' A' ' 22' ' ' TYR . 40.2 mm -78.67 116.9 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 168.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -64.61 -56.24 15.14 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 124.306 1.042 . . . . 0.0 109.179 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -141.26 165.94 26.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.11 0.964 . . . . 0.0 110.195 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -146.62 139.19 25.12 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.652 0.781 . . . . 0.0 109.71 -173.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -157.34 170.9 21.42 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.866 1.266 . . . . 0.0 108.49 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 t -129.16 132.88 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 118.665 0.666 . . . . 0.0 109.627 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.408 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 66.4 ttt180 -144.15 122.89 12.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.546 0.739 . . . . 0.0 109.231 -177.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.408 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 93.1 mttt 65.24 26.63 12.25 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.752 1.221 . . . . 0.0 111.76 176.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.85 -10.8 72.54 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.866 -176.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -98.79 115.12 28.08 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.844 0.858 . . . . 0.0 110.471 -176.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.4 112.09 14.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -92.23 143.44 26.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.187 0.995 . . . . 0.0 109.679 -175.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.533 ' HB3' HD13 ' A' ' 10' ' ' ILE . 66.8 m-85 -129.96 117.54 20.25 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.0 tp -68.63 89.09 0.36 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 172.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.553 HG21 HD12 ' A' ' 42' ' ' ILE . 97.4 t -74.65 107.89 5.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.627 0 C-N-CA 123.594 0.758 . . . . 0.0 110.526 -174.477 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -79.45 100.25 7.59 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.524 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 80.1 m95 -68.19 127.42 32.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.071 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -64.8 -41.18 96.01 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.985 0.914 . . . . 0.0 112.027 -166.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.43 18.81 52.97 Favored Glycine 0 N--CA 1.474 1.231 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.578 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.524 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 87.9 m95 -129.79 140.7 39.43 Favored Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 123.798 0.839 . . . . 0.0 109.861 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.422 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 80.1 Cg_exo -51.91 154.33 10.24 Favored 'Trans proline' 0 C--N 1.382 2.315 0 C-N-CA 123.544 2.829 . . . . 0.0 113.989 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -53.65 -24.19 28.75 Favored 'Trans proline' 0 C--N 1.386 2.514 0 C-N-CA 123.949 3.1 . . . . 0.0 114.841 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.422 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 58.6 pttt -66.42 -28.55 68.7 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 122.675 0.39 . . . . 0.0 111.471 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -88.94 2.38 53.95 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.352 0.661 . . . . 0.0 112.15 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.7 p -67.3 117.32 9.15 Favored 'General case' 0 C--N 1.356 0.883 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.442 ' HG1' ' HG2' ' A' ' 37' ' ' GLU . 20.3 p -108.22 136.42 47.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.859 0.864 . . . . 0.0 110.506 -173.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -69.89 80.62 0.46 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.413 0.685 . . . . 0.0 110.173 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.468 ' HB2' HD12 ' A' ' 42' ' ' ILE . 15.4 mm-40 -94.67 116.0 65.92 Favored Pre-proline 0 C--O 1.239 0.508 0 C-N-CA 123.63 0.772 . . . . 0.0 109.025 177.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -66.0 172.19 8.91 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 121.992 1.795 . . . . 0.0 112.19 172.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -54.13 -28.67 41.3 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.687 1.195 . . . . 0.0 112.355 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -59.66 -34.81 73.32 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.185 1.394 . . . . 0.0 111.709 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -85.05 -31.55 23.35 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.507 -173.763 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.553 HD12 HG21 ' A' ' 24' ' ' VAL . 36.9 mm -86.62 144.49 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 124.061 0.944 . . . . 0.0 111.666 -167.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.07 -72.14 0.38 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.543 0.737 . . . . 0.0 110.513 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.33 117.75 64.31 Favored Pre-proline 0 CA--C 1.557 1.227 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -78.3 -15.91 14.0 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.427 2.085 . . . . 0.0 112.893 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -72.76 -12.45 61.01 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 111.981 -173.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.446 HD11 HG12 ' A' ' 7' ' ' VAL . 3.1 mm? -50.95 -45.06 60.55 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 123.048 0.539 . . . . 0.0 110.885 168.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.4 t -61.24 -49.88 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.387 -176.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -68.83 -37.24 79.04 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.089 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.53 93.87 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.833 0.853 . . . . 0.0 111.017 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.474 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 18.8 t80 -61.92 -53.29 57.82 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.857 0.863 . . . . 0.0 110.667 174.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.8 -36.85 76.03 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.4 -170.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.489 1.519 0 CA-C-N 118.097 0.408 . . . . 0.0 111.296 -178.686 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? . . . . . 0 C--O 1.241 0.619 0 CA-C-O 121.369 0.604 . . . . 0.0 111.035 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.37 112.81 22.03 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.138 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.529 ' HB1' HD11 ' A' ' 42' ' ' ILE . . . -97.41 168.67 10.25 Favored 'General case' 0 C--O 1.245 0.841 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 169.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 122.92 0.488 . . . . 0.0 110.101 -169.525 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.82 0.343 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.8 t -103.05 127.71 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.348 1.059 . . . . 0.0 108.729 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.448 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 76.1 m-85 -138.87 158.04 44.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.368 0.667 . . . . 0.0 109.868 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.93 101.11 5.06 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 171.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -72.14 139.57 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.186 0.994 . . . . 0.0 110.996 -175.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.441 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 28.4 tt0 -73.11 -51.79 16.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.62 0.768 . . . . 0.0 109.907 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.9 p -175.07 -175.84 0.89 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.054 1.341 . . . . 0.0 109.403 175.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.515 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 42.9 mm -97.65 117.65 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 169.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.476 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.1 tmt_? -74.1 -58.07 3.54 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.5 1.12 . . . . 0.0 109.594 -177.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.476 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.3 mttm -136.72 178.83 6.77 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.8 0.84 . . . . 0.0 111.011 -176.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.422 ' HE3' HG13 ' A' ' 20' ' ' VAL . 86.1 tttt -158.42 147.57 19.17 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.51 1.124 . . . . 0.0 108.917 -175.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -164.03 143.81 8.03 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.995 0.918 . . . . 0.0 109.369 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.41 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 13.1 p -88.05 141.65 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.449 ' HA ' ' HE ' ' A' ' 16' ' ' ARG . 2.3 tpm_? -142.31 99.17 3.45 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.843 0.857 . . . . 0.0 108.747 -174.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 60.39 29.81 19.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.382 1.073 . . . . 0.0 111.487 -176.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.82 -17.35 58.85 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-N 116.264 -0.426 . . . . 0.0 113.417 -175.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.49 111.59 22.0 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.266 0.626 . . . . 0.0 110.067 177.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.422 HG13 ' HE3' ' A' ' 13' ' ' LYS . 50.6 t -85.44 111.39 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.006 -175.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.413 ' HB3' ' HB3' ' A' ' 36' ' ' TRP . 34.5 mm-40 -94.17 140.63 29.52 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.3 1.44 . . . . 0.0 109.411 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -120.12 120.55 36.55 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.7 tp -68.82 86.86 0.34 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 172.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.483 HG21 HD13 ' A' ' 42' ' ' ILE . 88.4 t -73.18 106.08 2.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.187 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -74.54 100.54 3.91 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.7 m95 -73.24 145.03 46.48 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.664 ' HB2' ' HZ3' ' A' ' 27' ' ' LYS . 3.8 ttmp? -71.24 -39.82 71.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 122.757 0.423 . . . . 0.0 111.836 -173.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.78 -10.97 74.94 Favored Glycine 0 C--N 1.346 1.112 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.403 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 23.3 m95 -110.24 141.67 24.37 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.496 0.718 . . . . 0.0 109.468 -176.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.73 163.65 36.72 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.414 2.076 . . . . 0.0 111.249 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.75 -26.28 72.58 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.045 2.497 . . . . 0.0 113.704 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.542 ' HZ1' ' HB3' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -66.34 -38.71 88.27 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.253 0.621 . . . . 0.0 110.881 176.349 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.413 ' HB3' ' HE3' ' A' ' 29' ' ' TRP . 39.6 m-85 -99.05 0.45 43.75 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.463 0.705 . . . . 0.0 111.917 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.0 m -70.0 129.48 39.57 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.4 p -109.61 148.94 30.43 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.16 0.584 . . . . 0.0 111.833 -169.74 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 87.5 m95 -77.01 86.81 3.52 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.039 0.935 . . . . 0.0 110.402 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.481 ' HB2' HG21 ' A' ' 24' ' ' VAL . 38.8 mm-40 -97.9 118.44 63.89 Favored Pre-proline 0 C--O 1.241 0.647 0 C-N-CA 123.63 0.772 . . . . 0.0 109.305 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.414 ' O ' HG12 ' A' ' 42' ' ' ILE . 73.9 Cg_endo -73.65 177.46 7.99 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.176 1.917 . . . . 0.0 112.117 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.99 -27.2 51.79 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.745 1.218 . . . . 0.0 112.098 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.93 -28.72 69.73 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.918 1.287 . . . . 0.0 111.914 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -99.72 -28.76 13.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.045 0.938 . . . . 0.0 113.124 -172.803 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.483 HD13 HG21 ' A' ' 24' ' ' VAL . 43.8 mm -79.65 145.75 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 C-N-CA 123.948 0.899 . . . . 0.0 112.84 -169.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 mt -78.43 -64.34 1.19 Allowed 'General case' 0 C--N 1.358 0.974 0 C-N-CA 123.946 0.898 . . . . 0.0 110.852 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.93 117.46 65.12 Favored Pre-proline 0 N--CA 1.485 1.313 0 CA-C-O 119.412 -0.327 . . . . 0.0 110.628 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.99 -35.3 12.2 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.322 2.682 . . . . 0.0 112.6 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.0 mtm180 -70.45 -16.9 62.98 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.524 -174.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.5 tp -57.64 -44.03 85.33 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.537 1.135 . . . . 0.0 111.342 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.6 t -66.37 -41.94 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.543 0.737 . . . . 0.0 110.337 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.2 mtp -63.06 -30.49 71.64 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.397 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -37.01 85.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.678 0.791 . . . . 0.0 110.869 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.515 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.8 t80 -72.09 -35.04 69.11 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.973 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -64.03 -29.49 70.64 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.572 0.349 . . . . 0.0 110.589 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 N--CA 1.474 0.771 0 C-N-CA 123.34 0.656 . . . . 0.0 111.679 173.747 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 91.7 mttt . . . . . 0 C--O 1.238 0.469 0 CA-C-O 121.055 0.455 . . . . 0.0 111.839 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.53 127.9 54.34 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.161 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -110.78 162.19 15.03 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 169.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 . . . . . 0 C--O 1.24 0.556 0 C-N-CA 123.09 0.556 . . . . 0.0 110.025 -172.824 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 . . . . . 0 N--CA 1.476 0.841 0 CA-C-O 121.391 0.615 . . . . 0.0 111.789 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 69.1 t -128.31 129.36 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 125.378 1.471 . . . . 0.0 107.878 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -141.7 162.59 35.11 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.367 0.667 . . . . 0.0 110.569 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.98 131.29 44.84 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.271 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.444 HG12 HD11 ' A' ' 47' ' ' LEU . 2.2 p -123.14 133.89 67.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 124.863 1.265 . . . . 0.0 108.55 -174.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -80.46 -40.39 26.32 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.706 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.3 p -175.91 179.46 1.33 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.788 0.835 . . . . 0.0 110.289 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.9 mm -89.73 122.78 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 165.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.525 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -80.89 -51.2 8.83 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.442 0.697 . . . . 0.0 109.371 -178.27 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -137.11 171.77 14.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.621 0.768 . . . . 0.0 111.104 -175.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -155.24 143.25 20.04 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.538 0.735 . . . . 0.0 109.953 -174.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -160.91 144.43 13.25 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.701 0.8 . . . . 0.0 109.614 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.61 115.54 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -121.0 119.8 33.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.347 1.059 . . . . 0.0 109.41 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 63.51 25.65 14.52 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.175 0.99 . . . . 0.0 112.146 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.0 -12.78 52.43 Favored Glycine 0 N--CA 1.475 1.244 0 CA-C-N 116.227 -0.442 . . . . 0.0 113.053 -174.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.721 ' HB3' ' HZ2' ' A' ' 19' ' ' LYS . 1.3 mmmp? -83.67 111.64 19.32 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.494 1.118 . . . . 0.0 108.546 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 t -82.09 106.23 12.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -97.3 142.9 28.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.459 1.104 . . . . 0.0 109.61 -174.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -127.25 126.22 42.32 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.601 0.76 . . . . 0.0 109.693 -176.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.455 HD22 ' HB3' ' A' ' 11' ' ' ARG . 50.0 tp -67.7 94.17 0.42 Allowed 'General case' 0 C--N 1.349 0.583 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.474 HG21 HD12 ' A' ' 42' ' ' ILE . 90.1 t -77.1 104.01 4.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.879 -178.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 26.6 tptp -79.97 99.99 7.89 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -177.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.6 m95 -67.05 136.43 55.22 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -58.7 -33.75 70.53 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.037 0.535 . . . . 0.0 111.024 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.54 -55.43 2.71 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.495 176.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 98.4 m95 -77.97 129.57 75.55 Favored Pre-proline 0 CA--C 1.563 1.443 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -170.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.49 160.13 1.78 Allowed 'Trans proline' 0 C--N 1.387 2.603 0 C-N-CA 124.673 3.582 . . . . 0.0 113.465 172.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.45 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 32.1 Cg_endo -60.55 -17.8 50.67 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 123.132 2.554 . . . . 0.0 114.415 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.7 pttt -83.13 -32.65 26.56 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.639 0.376 . . . . 0.0 111.214 174.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -87.22 -8.67 56.59 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.108 0.563 . . . . 0.0 110.578 173.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' SER . . . . . 0.41 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 68.0 m -73.44 133.25 43.65 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 171.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.8 p -99.44 133.36 43.87 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.558 0.743 . . . . 0.0 111.075 -168.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -75.02 83.54 2.26 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.263 0.625 . . . . 0.0 110.106 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.447 ' HB2' HG21 ' A' ' 24' ' ' VAL . 44.4 mm-40 -104.85 130.59 22.91 Favored Pre-proline 0 N--CA 1.468 0.444 0 C-N-CA 123.262 0.625 . . . . 0.0 110.448 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.403 ' O ' HG12 ' A' ' 42' ' ' ILE . 40.0 Cg_endo -64.54 164.46 23.55 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 122.003 1.802 . . . . 0.0 112.037 170.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -52.86 -30.51 34.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.46 1.104 . . . . 0.0 111.701 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.9 -34.59 78.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.212 1.405 . . . . 0.0 111.468 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.0 m170 -85.1 -9.94 57.37 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.961 0.904 . . . . 0.0 112.793 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.474 HD12 HG21 ' A' ' 24' ' ' VAL . 38.8 mm -90.48 155.94 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 123.943 0.897 . . . . 0.0 110.959 -176.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -84.13 -77.67 0.26 Allowed 'General case' 0 C--N 1.353 0.748 0 C-N-CA 123.128 0.571 . . . . 0.0 109.98 167.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -75.14 127.92 85.72 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-O 119.673 -0.203 . . . . 0.0 111.168 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.26 -31.34 22.96 Favored 'Trans proline' 0 C--N 1.375 1.937 0 C-N-CA 122.547 2.164 . . . . 0.0 113.802 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.2 -14.42 37.74 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.444 HD11 HG12 ' A' ' 7' ' ' VAL . 3.5 mm? -60.3 -50.59 73.03 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 118.749 0.704 . . . . 0.0 110.012 170.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.481 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 74.1 t -67.51 -54.01 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.882 178.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.418 ' SD ' ' N ' ' A' ' 49' ' ' MET . 0.4 OUTLIER -58.97 -45.48 90.43 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.746 0.819 . . . . 0.0 112.09 -173.369 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.12 87.3 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.281 0.363 . . . . 0.0 111.175 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.45 -37.34 86.6 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.061 0.945 . . . . 0.0 110.747 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 31.0 mm-40 -69.95 -23.13 63.14 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.282 0.633 . . . . 0.0 111.081 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 . . . . . 0 N--CA 1.48 1.055 0 C-N-CA 124.27 1.028 . . . . 0.0 112.227 -179.684 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt . . . . . 0 C--O 1.242 0.66 0 CA-C-O 121.131 0.491 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -112.77 134.06 54.48 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.714 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.462 ' HB2' HD11 ' A' ' 42' ' ' ILE . . . -109.19 -175.69 2.83 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 171.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 . . . . . 0 C--O 1.238 0.499 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -170.36 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 . . . . . 0 CA--C 1.541 0.597 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -102.01 136.1 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.012 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -138.58 153.85 48.69 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.895 0.878 . . . . 0.0 109.014 170.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.66 134.38 47.49 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 173.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -120.63 141.78 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.211 1.005 . . . . 0.0 110.164 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -73.65 -60.27 2.33 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.579 174.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.3 p -170.91 -174.61 1.58 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.425 1.09 . . . . 0.0 109.548 -175.349 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.523 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 50.8 mm -97.87 117.86 43.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.24 -50.18 35.56 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.048 0.939 . . . . 0.0 110.529 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -140.72 170.8 15.09 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.475 0.71 . . . . 0.0 110.634 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -155.77 148.5 24.1 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.894 0.878 . . . . 0.0 108.635 -175.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.464 ' NH1' ' HD2' ' A' ' 16' ' ' ARG . 2.2 ptm180 -159.92 154.67 24.32 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.59 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -104.44 137.4 33.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 166.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.464 ' HD2' ' NH1' ' A' ' 14' ' ' ARG . 75.4 ttt180 -150.52 98.6 2.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -168.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 65.55 25.42 11.75 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.549 0.74 . . . . 0.0 111.115 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.71 -16.16 59.91 Favored Glycine 0 C--N 1.355 1.595 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.817 -173.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -84.24 111.32 19.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.9 t -86.95 108.04 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -97.05 144.43 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.126 0.57 . . . . 0.0 109.605 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.43 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.3 m-85 -123.45 116.82 23.86 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.7 tp -68.09 88.02 0.28 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 170.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.85 106.98 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.938 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -76.98 96.97 4.5 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.9 m95 -68.69 145.53 53.78 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -80.62 -30.35 36.75 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.6 -10.65 84.97 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 115.897 -0.592 . . . . 0.0 113.669 177.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.3 m95 -131.15 132.36 23.7 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 110.199 -177.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.411 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 32.4 Cg_endo -62.94 170.11 7.92 Favored 'Trans proline' 0 CA--C 1.572 2.395 0 C-N-CA 122.853 2.369 . . . . 0.0 112.483 175.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.62 -24.2 69.21 Favored 'Trans proline' 0 C--N 1.394 2.947 0 C-N-CA 122.793 2.328 . . . . 0.0 114.016 -174.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.86 -28.24 65.5 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.389 0.676 . . . . 0.0 112.512 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.525 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 80.2 m-85 -96.84 -3.59 41.83 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.17 0.588 . . . . 0.0 111.579 175.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.3 m -66.79 132.86 48.95 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.677 0.391 . . . . 0.0 109.988 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.1 p -122.79 150.37 42.9 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.651 -169.878 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -80.55 83.17 6.4 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.622 0.769 . . . . 0.0 110.521 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -95.17 121.22 62.75 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.57 165.39 29.45 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 121.853 1.702 . . . . 0.0 111.088 172.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -53.8 -27.25 28.12 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.078 0.951 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -60.3 -40.95 92.33 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.796 1.239 . . . . 0.0 110.992 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 17.3 m170 -81.45 -29.76 33.68 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.426 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.92 143.95 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.473 0.709 . . . . 0.0 111.348 -175.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' B' ' 24' ' ' ALA . 5.1 tt -82.69 -77.53 0.23 Allowed 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.65 122.42 85.76 Favored Pre-proline 0 CA--C 1.556 1.186 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.33 -15.54 22.48 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 122.779 2.319 . . . . 0.0 114.107 -175.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 50.0 mtm180 -71.02 -12.14 61.36 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.25 -42.11 80.9 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 118.134 0.425 . . . . 0.0 111.127 170.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.498 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 48.0 t -62.12 -50.33 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.2 mmt -57.48 -40.16 77.97 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.129 0.972 . . . . 0.0 111.66 -177.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.17 -33.76 76.77 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.054 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.523 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 83.1 t80 -74.83 -37.67 62.23 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.429 0.692 . . . . 0.0 110.485 174.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 18.8 mm-40 -67.51 -20.49 65.45 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.792 0.437 . . . . 0.0 110.709 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 123.699 0.799 . . . . 0.0 112.267 174.805 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . 0.418 ' HZ2' ' HB3' ' B' ' 23' ' ' LYS . 1.7 mmmp? . . . . . 0 C--O 1.246 0.896 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . 0.407 ' O ' ' HB3' ' A' ' 43' ' ' LEU . . . -121.28 125.46 47.11 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -94.6 -179.25 4.82 Favored 'General case' 0 C--O 1.244 0.794 0 N-CA-C 107.921 -1.141 . . . . 0.0 107.921 169.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 . . . . . 0 C--O 1.239 0.501 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -169.306 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 121.347 0.594 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.8 t -124.99 122.51 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -133.3 160.97 35.76 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 123.31 0.644 . . . . 0.0 109.967 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.02 136.3 55.06 Favored 'General case' 0 C--O 1.248 1.017 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 p -116.34 145.27 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.82 0.848 . . . . 0.0 110.178 -174.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -78.87 -56.17 4.6 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.803 0.841 . . . . 0.0 109.748 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.0 p -175.19 -171.53 0.52 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.491 1.116 . . . . 0.0 110.2 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.494 HD11 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -99.68 117.97 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 170.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -52.17 14.08 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.509 1.124 . . . . 0.0 110.221 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -139.72 169.41 17.78 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.418 0.687 . . . . 0.0 111.353 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -155.77 137.67 14.44 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.313 1.045 . . . . 0.0 108.781 -177.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -160.94 137.63 8.7 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.98 0.912 . . . . 0.0 108.935 177.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.46 129.85 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -136.61 113.76 10.64 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? 62.21 33.41 16.77 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 124.547 1.139 . . . . 0.0 109.459 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.84 -18.94 18.2 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.749 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -84.54 111.01 19.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.51 0.724 . . . . 0.0 109.303 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.9 t -78.59 110.77 14.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -93.98 138.76 31.73 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.61 1.164 . . . . 0.0 109.894 -171.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.494 ' HB3' HD11 ' A' ' 10' ' ' ILE . 79.1 m-85 -125.54 116.42 21.74 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.432 0.693 . . . . 0.0 109.434 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.8 tp -69.54 91.52 0.59 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 170.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.599 HG22 HD11 ' A' ' 42' ' ' ILE . 73.1 t -73.43 106.18 3.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.174 -175.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.527 ' HE2' ' HD3' ' A' ' 31' ' ' PRO . 25.4 tptp -76.2 102.4 5.78 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 174.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -73.21 154.68 40.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.087 0.555 . . . . 0.0 110.894 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -75.75 -44.28 42.54 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 171.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.48 -41.42 30.12 Favored Glycine 0 C--N 1.352 1.462 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.194 -178.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -100.91 143.19 26.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.231 0.612 . . . . 0.0 111.166 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.37 172.86 14.11 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 123.5 2.8 . . . . 0.0 112.415 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . 0.527 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 30.0 Cg_endo -61.21 -29.23 86.25 Favored 'Trans proline' 0 C--N 1.394 2.921 0 C-N-CA 122.963 2.442 . . . . 0.0 113.401 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -67.5 -30.05 69.63 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.296 0.638 . . . . 0.0 111.401 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 13.88 29.27 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.629 0.771 . . . . 0.0 111.614 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.9 m -74.43 136.03 42.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 169.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.8 p -114.84 138.16 51.1 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.492 0.717 . . . . 0.0 112.046 -168.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -74.88 87.76 2.29 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.542 0.737 . . . . 0.0 109.899 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.446 ' HB2' HD11 ' A' ' 42' ' ' ILE . 42.9 mm-40 -108.87 116.61 55.48 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 123.894 0.878 . . . . 0.0 109.905 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -63.25 169.15 9.83 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 122.551 2.167 . . . . 0.0 112.699 169.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -34.81 48.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.306 1.442 . . . . 0.0 113.244 -178.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -67.72 -34.37 76.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.893 0.877 . . . . 0.0 110.867 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -78.78 -17.8 55.19 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.625 0.77 . . . . 0.0 111.455 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.599 HD11 HG22 ' A' ' 24' ' ' VAL . 48.9 mm -98.5 148.78 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 124.359 1.064 . . . . 0.0 110.749 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.7 mt -82.1 -70.62 0.53 Allowed 'General case' 0 C--N 1.352 0.675 0 C-N-CA 123.49 0.716 . . . . 0.0 109.919 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -77.01 132.74 70.36 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.902 -171.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.433 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 98.1 Cg_endo -78.48 -30.44 3.2 Favored 'Trans proline' 0 CA--C 1.562 1.913 0 C-N-CA 122.52 2.147 . . . . 0.0 115.0 -176.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.433 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.32 0.0 OUTLIER -72.61 -9.7 58.91 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.031 . . . . . . . . 4 4 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -53.18 -47.91 68.44 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 119.117 0.871 . . . . 0.0 109.911 166.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.421 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 63.0 t -60.87 -45.65 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.248 177.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.475 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 53.4 mtt -64.09 -30.1 71.19 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.649 0.78 . . . . 0.0 111.305 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.44 78.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 0.0 110.115 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -75.45 -35.12 60.96 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.743 174.389 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.7 mm-40 -69.76 -32.66 71.3 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.583 0.353 . . . . 0.0 111.063 -177.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 49' ' ' MET . 22.0 mm-40 . . . . . 0 N--CA 1.477 0.9 0 C-N-CA 123.344 0.658 . . . . 0.0 111.179 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt . . . . . 0 C--O 1.251 1.166 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -110.08 109.21 19.67 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.996 176.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.434 ' HB2' HD13 ' A' ' 42' ' ' ILE . . . -97.21 172.15 7.99 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 167.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.7 ttp180 . . . . . 0 CA--C 1.541 0.602 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.516 -165.282 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 120.988 0.423 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.9 t -91.83 132.56 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -131.93 163.0 29.31 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 171.865 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . 0.421 ' HB3' ' HE3' ' A' ' 27' ' ' LYS . . . -85.57 116.34 23.81 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.151 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.561 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -98.46 141.17 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.693 1.197 . . . . 0.0 109.28 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.49 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 9.7 tp10 -80.26 -49.53 11.47 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.0 p -171.38 171.79 5.41 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.142 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.54 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 49.5 mm -88.27 113.76 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.411 -0.813 . . . . 0.0 108.865 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -72.06 -53.07 13.98 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.546 0.738 . . . . 0.0 109.415 -178.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -137.82 173.89 11.16 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.316 0.646 . . . . 0.0 111.249 -176.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -157.5 150.38 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.974 0.91 . . . . 0.0 109.322 -174.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.9 ptt85 -168.23 178.75 4.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.622 1.169 . . . . 0.0 109.029 173.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.43 132.94 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.871 0.868 . . . . 0.0 108.747 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -142.64 111.76 6.52 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 59.91 42.61 16.02 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.575 1.15 . . . . 0.0 112.383 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.89 -17.32 32.24 Favored Glycine 0 N--CA 1.471 0.985 0 CA-C-N 115.8 -0.636 . . . . 0.0 113.516 176.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -84.73 109.91 18.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.1 t -83.92 104.13 11.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 171.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 1.0 OUTLIER -103.28 144.74 30.95 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.824 0.821 . . . . 0.0 110.9 -175.758 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -119.11 124.13 46.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.355 -173.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.1 tp -65.57 89.27 0.1 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 170.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.476 HG23 ' HB2' ' A' ' 37' ' ' GLU . 74.1 t -76.01 105.57 5.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.173 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -83.99 99.95 10.74 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 53.0 m95 -66.83 134.58 52.4 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -70.42 -15.96 62.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.479 0.312 . . . . 0.0 111.651 -177.694 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.09 10.11 22.74 Favored Glycine 0 C--N 1.351 1.373 0 CA-C-O 119.666 -0.519 . . . . 0.0 113.664 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 81.0 m95 -134.91 148.17 65.86 Favored Pre-proline 0 N--CA 1.498 1.965 0 CA-C-N 117.748 0.774 . . . . 0.0 110.158 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -74.53 165.27 32.05 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.911 2.407 . . . . 0.0 112.062 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.55 -33.87 49.87 Favored 'Trans proline' 0 C--N 1.391 2.775 0 C-N-CA 124.084 3.189 . . . . 0.0 114.646 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -69.43 -30.21 68.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.061 0.544 . . . . 0.0 112.357 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -95.05 -8.41 36.77 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.609 0.764 . . . . 0.0 111.441 175.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 59.4 m -75.35 112.23 11.44 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.4 p -98.36 147.79 24.33 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.64 0.776 . . . . 0.0 111.795 -169.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -75.12 89.02 2.46 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.441 0.696 . . . . 0.0 110.226 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.476 ' HB2' HG23 ' A' ' 24' ' ' VAL . 45.8 mm-40 -97.89 119.5 62.16 Favored Pre-proline 0 N--CA 1.469 0.507 0 C-N-CA 123.461 0.704 . . . . 0.0 109.872 178.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.523 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 47.4 Cg_endo -66.31 167.49 18.38 Favored 'Trans proline' 0 C--N 1.369 1.636 0 C-N-CA 122.07 1.846 . . . . 0.0 112.001 172.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.07 -27.0 61.33 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.416 1.087 . . . . 0.0 112.262 176.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.42 -35.33 65.28 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 125.176 1.39 . . . . 0.0 111.717 171.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 16.6 m170 -93.44 -18.15 22.66 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.075 0.95 . . . . 0.0 112.559 -173.92 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.426 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.1 mm -86.54 151.57 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.061 0.944 . . . . 0.0 111.352 -171.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -96.73 -69.15 0.77 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.749 0.82 . . . . 0.0 110.823 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.15 117.34 53.38 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 72.0 Cg_endo -74.37 -17.83 20.93 Favored 'Trans proline' 0 C--N 1.369 1.646 0 C-N-CA 122.722 2.281 . . . . 0.0 113.185 -175.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.404 ' HD3' ' HG2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -72.22 -12.22 61.07 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.502 0.721 . . . . 0.0 112.481 -177.652 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -52.13 -51.06 60.22 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 118.512 0.597 . . . . 0.0 110.59 169.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 59.3 t -61.04 -48.4 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 124.107 0.879 . . . . 0.0 109.694 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.2 mmt -60.44 -38.49 84.31 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.998 -175.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.84 -36.41 83.39 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.754 0.821 . . . . 0.0 110.571 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.54 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 81.5 t80 -69.8 -42.72 73.36 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.723 0.809 . . . . 0.0 110.424 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.3 mm-40 -60.69 -37.88 83.14 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.263 0.625 . . . . 0.0 111.285 -177.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 . . . . . 0 N--CA 1.476 0.834 0 C-N-CA 123.884 0.873 . . . . 0.0 112.218 -179.482 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 71.8 mttt . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -107.06 106.64 17.25 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.097 0.475 . . . . 0.0 110.761 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -106.75 151.05 25.66 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 162.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--N 1.316 -0.875 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -175.098 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 . . . . . 0 CA--C 1.542 0.648 0 CA-C-O 120.63 0.253 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 91.4 t -103.24 116.19 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.565 0.746 . . . . 0.0 109.108 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -130.34 167.03 19.18 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 123.718 0.807 . . . . 0.0 109.402 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.13 122.06 19.44 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.2 p -97.97 135.94 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.356 0.662 . . . . 0.0 110.177 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -68.19 -52.72 31.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.951 0.901 . . . . 0.0 110.007 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.2 p -177.72 178.0 1.05 Allowed 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.714 -176.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.457 HD12 ' HB3' ' A' ' 22' ' ' TYR . 47.9 mm -89.95 114.99 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 168.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.549 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -69.82 -51.4 33.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.643 0.777 . . . . 0.0 109.05 -179.393 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -139.26 161.82 36.49 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.301 0.641 . . . . 0.0 111.348 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . 0.507 ' HE3' HG11 ' A' ' 20' ' ' VAL . 83.1 tttt -147.69 133.35 18.85 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 108.064 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -159.29 139.39 11.97 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 123.476 0.71 . . . . 0.0 109.396 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.471 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 5.0 p -87.22 121.41 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -134.46 123.49 24.07 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.74 0.816 . . . . 0.0 109.045 -176.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 64.24 28.02 13.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.324 1.05 . . . . 0.0 111.854 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.83 -16.97 53.31 Favored Glycine 0 C--N 1.351 1.406 0 CA-C-N 115.484 -0.78 . . . . 0.0 113.258 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -105.46 134.3 48.8 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.82 0.848 . . . . 0.0 110.443 -176.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.507 HG11 ' HE3' ' A' ' 13' ' ' LYS . 21.7 t -83.2 116.36 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -174.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -95.36 142.03 28.23 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 124.895 1.278 . . . . 0.0 109.741 -178.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.457 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.1 m-85 -125.0 120.44 31.56 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.49 0.716 . . . . 0.0 109.75 -178.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.502 HD23 ' HD2' ' A' ' 11' ' ' ARG . 27.7 tp -75.22 82.32 2.37 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 169.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.432 HG22 HD13 ' A' ' 42' ' ' ILE . 67.1 t -68.65 106.49 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.421 -175.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.549 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.3 tptp -84.53 102.82 13.15 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.58 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.8 m95 -71.5 147.05 48.14 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.247 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -78.44 -36.14 45.87 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.157 0.583 . . . . 0.0 109.903 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.43 -14.45 82.16 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.775 178.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.58 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.4 m95 -120.3 148.92 48.51 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 123.253 0.621 . . . . 0.0 111.381 -175.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 169.97 20.62 Favored 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.22 2.613 . . . . 0.0 112.2 175.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -55.52 -26.43 54.45 Favored 'Trans proline' 0 C--N 1.393 2.893 0 C-N-CA 123.715 2.943 . . . . 0.0 114.999 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -70.41 -9.23 55.8 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.408 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 69.5 m-85 -118.02 14.25 14.06 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.869 0.867 . . . . 0.0 111.409 175.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -70.07 116.8 10.86 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.0 p -105.36 137.19 43.56 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.297 0.639 . . . . 0.0 111.878 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -73.87 83.43 1.68 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.111 0.564 . . . . 0.0 109.933 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -110.62 113.14 55.96 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 123.892 0.877 . . . . 0.0 108.863 176.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -66.8 166.84 21.1 Favored 'Trans proline' 0 C--N 1.365 1.424 0 C-N-CA 122.238 1.959 . . . . 0.0 111.782 173.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.21 -23.87 50.75 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.582 1.153 . . . . 0.0 112.807 -177.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -62.46 -27.25 68.99 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.106 1.362 . . . . 0.0 111.655 178.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -113.01 2.84 15.9 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.398 1.079 . . . . 0.0 112.408 -173.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.539 HD12 ' HB3' ' B' ' 25' ' ' ALA . 48.8 mm -101.16 148.55 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 124.58 1.152 . . . . 0.0 110.793 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.612 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 53.5 mt -75.68 -78.93 0.1 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 122.989 0.515 . . . . 0.0 110.811 172.458 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -75.05 112.85 19.92 Favored Pre-proline 0 N--CA 1.48 1.07 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -174.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -78.21 -13.65 15.29 Favored 'Trans proline' 0 C--N 1.371 1.752 0 C-N-CA 122.872 2.382 . . . . 0.0 112.945 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.56 -12.38 61.34 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.469 0.708 . . . . 0.0 111.41 179.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.606 HD22 ' HZ1' ' B' ' 23' ' ' LYS . 3.1 mm? -51.05 -39.16 55.31 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.478 0.311 . . . . 0.0 110.87 167.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.5 -51.48 46.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 123.861 0.864 . . . . 0.0 110.882 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.438 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 28.3 ptm -64.08 -35.08 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.0 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.11 -34.03 76.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.672 0.789 . . . . 0.0 111.315 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.445 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 74.3 t80 -70.14 -35.36 74.01 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.458 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -85.14 -7.44 59.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.5 0.72 . . . . 0.0 111.965 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 49' ' ' MET . 43.8 mm-40 . . . . . 0 N--CA 1.473 0.677 0 C-N-CA 122.71 0.404 . . . . 0.0 109.978 166.67 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . 0.606 ' HZ1' HD22 ' A' ' 47' ' ' LEU . 6.8 mtpm? . . . . . 0 C--O 1.241 0.635 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 . . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -117.96 137.93 52.51 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.107 0.479 . . . . 0.0 111.041 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.539 ' HB3' HD12 ' A' ' 42' ' ' ILE . . . -102.9 -167.65 1.42 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.41 171.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . 0.612 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 75.9 ttt180 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -172.582 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 110.778 -0.082 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.0 t -88.3 127.19 41.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.464 0.706 . . . . 0.0 109.635 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.416 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 87.7 m-85 -140.58 152.76 45.74 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.291 0.636 . . . . 0.0 110.113 172.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.28 117.37 11.75 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 170.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -91.39 134.19 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 110.104 -177.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.536 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 43.8 tt0 -68.04 -43.68 78.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.424 0.69 . . . . 0.0 110.505 178.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 p 177.94 169.51 0.72 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.386 1.074 . . . . 0.0 110.399 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.472 HG22 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -82.19 113.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.267 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.489 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -73.02 -58.12 3.54 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -177.378 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -134.31 174.29 10.68 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.723 0.809 . . . . 0.0 109.789 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -159.85 141.59 12.95 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 123.756 0.822 . . . . 0.0 109.075 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -154.12 159.46 41.48 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.521 0.728 . . . . 0.0 109.755 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.404 HG23 HG21 ' A' ' 20' ' ' VAL . 40.8 t -104.13 130.25 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 168.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -146.73 111.53 5.31 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.3 tptt 65.43 26.35 11.91 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.809 1.243 . . . . 0.0 110.324 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.83 -9.21 46.0 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-N 115.228 -0.896 . . . . 0.0 113.156 -174.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.06 110.55 20.71 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.404 HG21 HG23 ' A' ' 15' ' ' VAL . 47.9 t -84.1 107.07 15.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -174.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -98.49 141.42 31.37 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.784 0.834 . . . . 0.0 110.477 -173.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.472 ' HB3' HG22 ' A' ' 10' ' ' ILE . 8.6 m-85 -114.23 125.01 53.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.9 tp -70.86 85.17 0.67 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.425 HG23 ' HB2' ' A' ' 37' ' ' GLU . 95.3 t -72.78 104.13 1.92 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.454 -173.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.8 tptp -84.0 100.34 11.0 Favored 'General case' 0 C--N 1.345 0.388 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.1 m95 -69.35 151.03 46.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.623 -179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.536 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 35.7 ttpt -67.88 -46.11 72.6 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 122.981 0.512 . . . . 0.0 111.419 -173.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.87 -6.15 72.81 Favored Glycine 0 C--N 1.35 1.34 0 CA-C-N 115.878 -0.601 . . . . 0.0 113.868 -176.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 56.3 m95 -114.85 129.49 24.97 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.404 0.682 . . . . 0.0 110.148 -175.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -61.57 165.35 13.64 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.155 2.57 . . . . 0.0 112.35 171.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -64.41 -8.95 18.38 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.378 2.718 . . . . 0.0 114.709 -175.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.614 ' HZ2' ' HB2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -73.58 -26.84 61.0 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.464 0.306 . . . . 0.0 110.998 173.531 . . . . . . . . 3 3 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -99.45 -12.41 20.24 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.813 0.845 . . . . 0.0 111.52 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.7 p -64.65 119.8 11.21 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.7 p -107.06 150.27 26.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.787 0.835 . . . . 0.0 111.113 -172.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -76.41 86.63 3.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.46 0.704 . . . . 0.0 110.194 178.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.425 ' HB2' HG23 ' A' ' 24' ' ' VAL . 47.2 mm-40 -98.17 110.19 55.1 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 123.607 0.763 . . . . 0.0 109.356 175.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.464 ' O ' HG12 ' A' ' 42' ' ' ILE . 61.7 Cg_endo -68.99 176.43 6.2 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.257 1.972 . . . . 0.0 112.114 172.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -60.08 -23.22 63.61 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.501 0.72 . . . . 0.0 112.354 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -58.45 -38.85 78.35 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 124.223 1.009 . . . . 0.0 110.975 172.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -94.18 -15.7 24.36 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.346 1.058 . . . . 0.0 112.457 -173.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 38' ' ' PRO . 46.6 mm -83.69 147.15 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 123.567 0.747 . . . . 0.0 112.121 -173.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -88.2 -70.47 0.63 Allowed 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.827 0.851 . . . . 0.0 109.896 172.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -77.42 115.97 53.88 Favored Pre-proline 0 CA--C 1.55 0.956 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 -176.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.3 -18.95 20.18 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.713 2.275 . . . . 0.0 112.955 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.459 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 75.2 mtm180 -73.99 -15.04 61.11 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.718 0.807 . . . . 0.0 111.974 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.9 mt -53.43 -52.55 59.04 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.029 0.932 . . . . 0.0 112.13 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.66 -34.97 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.238 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.459 ' SD ' ' HA ' ' A' ' 46' ' ' ARG . 57.5 mtt -59.97 -43.27 95.2 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.49 0.716 . . . . 0.0 111.017 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.62 78.48 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.389 0.676 . . . . 0.0 111.412 176.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -73.93 -32.94 63.75 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -75.38 -20.49 58.94 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.585 0.754 . . . . 0.0 112.118 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 . . . . . 0 N--CA 1.476 0.858 0 C-N-CA 123.081 0.552 . . . . 0.0 111.267 173.216 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt . . . . . 0 C--O 1.243 0.715 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -96.03 137.96 34.35 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.063 0.545 . . . . 0.0 110.557 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.99 167.52 12.08 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 169.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 60.1 ttp180 . . . . . 0 N--CA 1.469 0.499 0 CA-C-O 121.355 0.598 . . . . 0.0 109.565 -178.714 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 . . . . . 0 CA--C 1.543 0.695 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.38 134.24 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.342 1.057 . . . . 0.0 109.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -132.52 159.02 40.62 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 123.227 0.611 . . . . 0.0 109.633 172.365 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.03 124.97 24.54 Favored 'General case' 0 C--O 1.249 1.064 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 170.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.453 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 6.3 p -113.59 145.86 18.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 C-N-CA 124.019 0.927 . . . . 0.0 110.349 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -78.67 -61.59 1.96 Allowed 'General case' 0 C--O 1.245 0.828 0 C-N-CA 124.042 0.937 . . . . 0.0 109.935 179.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.7 p -167.47 -172.09 1.85 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.041 0.936 . . . . 0.0 110.024 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.4 mm -102.2 133.6 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.451 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -85.62 -58.67 2.57 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.359 1.063 . . . . 0.0 109.19 -177.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.451 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.6 mttm -132.54 179.68 5.99 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.788 0.835 . . . . 0.0 110.264 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -156.24 154.63 31.03 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -169.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -164.41 170.54 15.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.421 1.088 . . . . 0.0 109.454 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.72 112.94 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 171.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -129.9 112.7 13.8 Favored 'General case' 0 C--O 1.24 0.585 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -174.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 80.6 tttt 63.77 33.92 12.45 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.021 1.328 . . . . 0.0 110.199 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.32 -14.85 43.16 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.236 -0.893 . . . . 0.0 113.744 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.595 ' HZ3' ' HB2' ' A' ' 19' ' ' LYS . 9.7 mtmp? -84.2 112.38 20.21 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.412 0.685 . . . . 0.0 109.643 -179.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.12 106.52 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 49.1 mt-10 -103.77 137.16 42.18 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.959 0.904 . . . . 0.0 110.755 -170.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -119.0 126.83 52.64 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 124.326 1.05 . . . . 0.0 109.224 -171.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.41 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 33.4 tp -74.47 84.67 2.01 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.417 HG23 ' HB2' ' A' ' 37' ' ' GLU . 68.4 t -64.71 108.24 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 124.625 1.17 . . . . 0.0 111.174 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.6 tptp -94.64 102.23 14.12 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.241 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.571 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 21.1 m95 -74.72 152.58 39.09 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.663 0.785 . . . . 0.0 110.162 -178.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -80.7 -29.24 36.48 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 122.218 0.207 . . . . 0.0 111.262 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.36 -3.87 62.89 Favored Glycine 0 C--N 1.346 1.115 0 O-C-N 123.479 0.487 . . . . 0.0 113.023 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.571 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 62.0 m95 -124.23 127.86 25.2 Favored Pre-proline 0 CA--C 1.553 1.072 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -60.44 163.78 14.42 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 123.066 2.511 . . . . 0.0 112.234 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -61.93 -10.15 16.61 Favored 'Trans proline' 0 C--N 1.386 2.545 0 C-N-CA 123.007 2.471 . . . . 0.0 114.843 -174.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.544 ' HZ2' ' HB3' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -66.84 -31.29 71.81 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.815 0.279 . . . . 0.0 110.902 172.159 . . . . . . . . 3 3 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.414 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 60.6 m-85 -98.51 10.82 40.06 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 112.122 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.2 p -68.69 125.06 25.38 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.5 p -112.95 129.97 56.29 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.631 0.772 . . . . 0.0 111.588 -169.313 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -68.94 82.26 0.31 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.651 0.78 . . . . 0.0 110.708 175.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB2' HG23 ' A' ' 24' ' ' VAL . 21.5 mm-40 -107.9 115.68 58.39 Favored Pre-proline 0 C--O 1.243 0.749 0 C-N-CA 123.774 0.829 . . . . 0.0 109.149 177.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.455 ' O ' HG12 ' A' ' 42' ' ' ILE . 41.9 Cg_endo -63.68 168.91 10.84 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.481 2.121 . . . . 0.0 112.048 170.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.5 -19.34 63.49 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.17 -37.79 78.2 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.864 0.865 . . . . 0.0 111.129 169.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -87.37 -18.18 30.65 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 112.342 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.487 HD12 ' HB3' ' B' ' 25' ' ' ALA . 42.0 mm -93.74 146.15 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 124.277 0.986 . . . . 0.0 111.657 -172.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.455 HD12 ' HE ' ' B' ' 26' ' ' ARG . 95.6 mt -87.91 -65.51 1.01 Allowed 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.577 0.751 . . . . 0.0 110.87 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -72.12 124.27 90.62 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 122.921 0.489 . . . . 0.0 110.143 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.57 -17.88 20.36 Favored 'Trans proline' 0 C--N 1.374 1.879 0 C-N-CA 122.734 2.289 . . . . 0.0 112.995 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.522 ' HA ' ' HB3' ' A' ' 49' ' ' MET . 54.4 mtm180 -73.66 -11.44 60.41 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.784 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.77 -53.7 48.62 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.217 0.917 . . . . 0.0 110.925 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.514 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.7 p -69.3 -44.0 80.78 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.156 176.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.522 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 23.2 ttt -57.05 -41.95 79.63 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.395 0.678 . . . . 0.0 111.92 -177.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.14 73.86 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.936 0.894 . . . . 0.0 110.436 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -75.17 -28.14 59.96 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.67 176.436 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 23.8 mm-40 -81.82 -6.86 59.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.773 0.429 . . . . 0.0 111.822 177.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 . . . . . 0 N--CA 1.483 1.206 0 C-N-CA 122.898 0.479 . . . . 0.0 111.513 175.861 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mttp . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -138.75 111.26 7.55 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.378 0.671 . . . . 0.0 109.502 176.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.487 ' HB3' HD12 ' A' ' 42' ' ' ILE . . . -99.37 167.53 10.58 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.868 174.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . 0.455 ' HE ' HD12 ' A' ' 43' ' ' LEU . 15.2 ttm180 . . . . . 0 C--O 1.24 0.584 0 C-N-CA 123.255 0.622 . . . . 0.0 109.531 -176.704 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 . . . . . 0 N--CA 1.475 0.811 0 CA-C-O 121.471 0.653 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.7 t -117.42 131.99 68.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.797 1.639 . . . . 0.0 107.871 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . 0.417 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 69.1 m-85 -132.66 164.45 26.69 Favored 'General case' 0 C--O 1.248 0.98 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 173.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 104.93 1.54 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 168.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.499 HG13 HD11 ' A' ' 47' ' ' LEU . 2.9 p -89.57 138.57 19.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.711 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.08 -178.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.604 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 38.2 tt0 -71.81 -62.56 1.37 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.231 1.012 . . . . 0.0 109.561 176.52 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.414 ' HA ' HD13 ' A' ' 47' ' ' LEU . 27.7 p -173.6 -172.57 0.78 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.512 1.125 . . . . 0.0 109.216 -177.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.4 mm -94.78 133.16 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 169.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -99.2 -37.06 9.45 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.186 0.594 . . . . 0.0 110.558 -174.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -143.69 169.96 16.76 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.992 0.917 . . . . 0.0 109.921 176.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -152.48 149.29 28.39 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -174.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -163.71 -175.47 4.15 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.414 1.085 . . . . 0.0 109.487 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -144.02 141.63 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 173.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -137.9 107.89 6.35 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.616 0.767 . . . . 0.0 109.045 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.4 mttt 61.75 36.5 16.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.869 0.868 . . . . 0.0 111.482 173.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.62 -13.82 66.46 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.57 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HB3' ' HZ1' ' A' ' 19' ' ' LYS . 1.1 mmmp? -88.12 107.45 18.77 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.9 t -83.53 108.49 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -96.52 138.75 33.64 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.465 0.706 . . . . 0.0 110.197 -169.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -122.66 121.94 37.61 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.898 0.879 . . . . 0.0 108.633 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.1 tp -71.68 86.64 0.93 Allowed 'General case' 0 C--O 1.24 0.583 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 174.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 78.4 t -70.85 104.82 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.494 -176.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -81.37 100.24 9.13 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.417 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 21.7 m95 -76.14 124.43 27.41 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 172.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.604 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -72.37 113.93 9.94 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.658 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 118.07 -14.65 12.4 Favored Glycine 0 C--N 1.346 1.139 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.215 -172.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.407 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 59.8 m95 -110.07 135.19 20.54 Favored Pre-proline 0 N--CA 1.475 0.799 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.29 155.24 30.68 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.746 2.297 . . . . 0.0 112.869 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.43 -13.44 10.29 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 123.52 2.813 . . . . 0.0 114.298 176.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -82.75 -46.47 13.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.693 0.397 . . . . 0.0 110.196 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -79.68 -1.36 37.99 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.252 0.621 . . . . 0.0 112.206 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.6 p -64.68 132.14 48.87 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 165.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.1 p -109.75 138.21 46.44 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.039 0.536 . . . . 0.0 111.98 -166.428 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -74.29 87.31 1.98 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.41 0.684 . . . . 0.0 110.107 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -103.74 125.1 35.63 Favored Pre-proline 0 N--CA 1.468 0.473 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.423 ' O ' HG12 ' A' ' 42' ' ' ILE . 56.3 Cg_endo -67.55 166.37 24.14 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 121.845 1.697 . . . . 0.0 112.447 172.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -52.24 -31.08 30.64 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 125.457 1.503 . . . . 0.0 112.337 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -60.45 -35.75 76.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.518 1.527 . . . . 0.0 110.99 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -91.65 -14.34 30.29 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.2 1.0 . . . . 0.0 112.989 -175.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 38' ' ' PRO . 41.2 mm -88.41 153.07 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.076 0.55 . . . . 0.0 110.914 -175.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' B' ' 24' ' ' ALA . 89.1 mt -90.85 -67.22 0.86 Allowed 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 171.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -82.97 134.61 46.27 Favored Pre-proline 0 CA--C 1.565 1.555 0 C-N-CA 123.001 0.521 . . . . 0.0 110.588 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . 0.431 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 88.9 Cg_endo -79.83 -32.04 1.66 Allowed 'Trans proline' 0 CA--C 1.571 2.342 0 C-N-CA 122.72 2.28 . . . . 0.0 116.072 -177.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.431 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.26 0.0 OUTLIER -71.42 -11.38 60.85 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -166.739 . . . . . . . . 4 4 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.499 HD11 HG13 ' A' ' 7' ' ' VAL . 2.9 mm? -53.54 -46.63 70.25 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.807 0.731 . . . . 0.0 110.203 171.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 98.1 t -70.26 -42.38 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.758 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -68.98 -42.43 76.55 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.406 -175.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.21 -30.91 71.85 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.951 0.9 . . . . 0.0 111.868 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.02 -52.27 25.49 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.015 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -81.76 -17.7 46.78 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -172.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 . . . . . 0 N--CA 1.486 1.326 0 CA-C-N 117.992 0.36 . . . . 0.0 111.742 -176.268 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . 0.481 ' HE3' ' HA ' ' B' ' 23' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 43' ' ' LEU . . . -117.79 112.34 20.27 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -103.08 168.61 9.07 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 166.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 . . . . . 0 N--CA 1.471 0.58 0 CA-C-O 120.789 0.328 . . . . 0.0 110.139 -172.488 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 121.338 0.59 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 39.1 t -105.33 140.31 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 114.255 -1.339 . . . . 0.0 109.371 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -132.1 152.27 51.31 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.776 0.83 . . . . 0.0 109.166 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.03 128.27 35.09 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.46 132.47 70.62 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.439 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -69.29 -61.7 1.68 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.996 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.8 p -167.59 -169.34 1.18 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.758 -172.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.486 HD11 ' HB3' ' A' ' 22' ' ' TYR . 51.2 mm -105.5 139.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.426 ' HB3' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -92.64 -48.5 6.56 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.676 0.791 . . . . 0.0 109.97 -179.875 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -137.53 161.47 36.31 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.395 0.678 . . . . 0.0 111.156 -176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -146.22 142.91 28.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.819 0.848 . . . . 0.0 109.179 -177.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -165.13 143.99 6.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.788 0.835 . . . . 0.0 109.137 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.523 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 7.2 p -92.09 125.29 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -133.15 104.52 6.54 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.992 0.517 . . . . 0.0 109.611 -169.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 62.52 30.64 17.16 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.008 0.923 . . . . 0.0 110.656 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 -17.46 51.07 Favored Glycine 0 C--N 1.348 1.237 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.569 -174.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -94.87 109.99 21.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.632 0.773 . . . . 0.0 109.272 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.523 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.7 t -79.24 111.44 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -90.53 143.75 26.45 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 123.696 0.798 . . . . 0.0 109.786 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.486 ' HB3' HD11 ' A' ' 10' ' ' ILE . 98.6 m-85 -125.94 123.51 38.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.426 HD23 ' HB3' ' A' ' 11' ' ' ARG . 43.1 tp -71.47 84.23 0.82 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 169.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.587 HG23 HD11 ' A' ' 42' ' ' ILE . 99.8 t -69.09 104.37 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.086 -172.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -78.06 99.76 6.24 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.899 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.534 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.8 m95 -69.07 139.54 54.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.958 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.18 -31.63 70.37 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 120.718 0.294 . . . . 0.0 110.559 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.74 -26.16 47.07 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.929 -0.578 . . . . 0.0 113.616 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.534 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 94.4 m95 -110.87 138.48 21.13 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 122.968 0.507 . . . . 0.0 111.363 -172.3 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -52.95 157.65 7.72 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.526 2.817 . . . . 0.0 113.248 173.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -57.82 -20.24 42.77 Favored 'Trans proline' 0 C--N 1.383 2.362 0 C-N-CA 123.327 2.685 . . . . 0.0 113.925 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -80.77 -31.39 35.87 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.377 0.671 . . . . 0.0 111.434 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -88.9 -4.37 58.48 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.383 0.673 . . . . 0.0 111.174 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.8 m -68.19 137.45 54.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.216 0.607 . . . . 0.0 109.606 172.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.9 p -111.88 143.2 43.23 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.051 0.541 . . . . 0.0 111.826 -170.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -75.57 85.66 2.64 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.669 0.788 . . . . 0.0 110.145 177.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.502 ' HB2' HD11 ' A' ' 42' ' ' ILE . 28.1 mm-40 -102.98 128.06 28.53 Favored Pre-proline 0 C--O 1.238 0.465 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.15 162.28 40.85 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.753 1.636 . . . . 0.0 110.9 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.98 -16.48 43.45 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.984 0.514 . . . . 0.0 112.01 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -55.67 -50.84 69.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.803 1.241 . . . . 0.0 109.996 170.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -76.96 -16.67 59.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.732 -174.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.587 HD11 HG23 ' A' ' 24' ' ' VAL . 46.0 mm -91.43 147.03 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.207 1.003 . . . . 0.0 111.161 -172.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 62.6 mt -87.34 -71.12 0.58 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 122.966 0.506 . . . . 0.0 109.641 172.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . 0.416 ' O ' HD21 ' A' ' 47' ' ' LEU . 14.3 t70 -68.92 112.58 11.94 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 122.919 0.488 . . . . 0.0 110.024 -176.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -81.65 -9.15 12.32 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.479 2.12 . . . . 0.0 113.187 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ttp180 -70.98 -16.54 62.64 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.787 0.835 . . . . 0.0 110.081 -178.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.466 HD13 ' HZ2' ' B' ' 23' ' ' LYS . 4.5 mm? -49.88 -47.39 52.01 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.759 0.824 . . . . 0.0 111.513 169.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.9 t -67.97 -50.43 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.823 0.849 . . . . 0.0 110.615 -178.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.405 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 25.8 mmt -58.5 -53.27 60.19 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.072 -177.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.89 78.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.574 1.15 . . . . 0.0 112.164 -177.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -62.63 -55.11 30.1 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.548 177.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -74.82 -6.18 47.62 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -170.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 49' ' ' MET . 60.7 mt-10 . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 121.02 0.438 . . . . 0.0 110.687 171.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . 0.466 ' HZ2' HD13 ' A' ' 47' ' ' LEU . 7.3 mtpm? . . . . . 0 C--O 1.244 0.796 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -136.77 130.09 31.43 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.557 0.694 . . . . 0.0 110.28 -178.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.57 ' HB1' HD13 ' A' ' 42' ' ' ILE . . . -109.73 166.34 10.99 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.729 178.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 . . . . . 0 C--O 1.239 0.533 0 C-N-CA 123.343 0.657 . . . . 0.0 109.326 -172.106 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 . . . . . 0 N--CA 1.471 0.594 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.523 HG23 ' HB3' ' B' ' 26' ' ' ARG . 48.4 t -85.74 103.94 13.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 123.721 0.808 . . . . 0.0 109.092 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -129.38 174.13 9.9 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.458 0.703 . . . . 0.0 110.703 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.76 114.26 20.28 Favored 'General case' 0 C--O 1.245 0.864 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.013 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.585 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.7 p -107.72 149.49 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.658 1.183 . . . . 0.0 109.93 -178.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 8.1 tp10 -86.02 -59.0 2.42 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.925 0.393 . . . . 0.0 109.992 174.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' SER . . . . . 0.494 ' HA ' HD13 ' A' ' 47' ' ' LEU . 15.9 p -169.6 179.89 3.61 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.77 -171.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.516 HD12 ' HB3' ' A' ' 22' ' ' TYR . 40.9 mm -86.64 128.61 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 172.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.48 ' HD2' HD22 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -76.28 -49.3 17.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.887 0.875 . . . . 0.0 109.472 176.518 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.8 tttp -148.72 164.71 33.56 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.61 0.364 . . . . 0.0 110.054 -172.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -142.24 154.01 44.42 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.151 0.58 . . . . 0.0 109.462 -171.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . 0.558 ' HG3' ' HB2' ' A' ' 21' ' ' GLU . 10.0 ptm180 -171.45 -174.24 1.38 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.247 1.419 . . . . 0.0 108.831 179.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -143.71 142.51 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -137.33 104.65 5.44 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.584 0.754 . . . . 0.0 109.069 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm 59.72 34.35 22.03 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.786 1.234 . . . . 0.0 111.302 177.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.79 -14.57 65.01 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 115.241 -0.89 . . . . 0.0 114.292 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -85.2 109.87 18.62 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.6 t -78.22 111.05 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -175.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.558 ' HB2' ' HG3' ' A' ' 14' ' ' ARG . 5.3 mm-40 -95.86 140.27 30.87 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.865 0.866 . . . . 0.0 110.575 -168.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.516 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.6 m-85 -129.99 121.52 26.69 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.871 0.868 . . . . 0.0 109.146 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.48 HD22 ' HD2' ' A' ' 11' ' ' ARG . 24.0 tp -73.68 80.06 1.53 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.3 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.581 HG22 HD13 ' A' ' 42' ' ' ILE . 40.8 t -65.17 106.18 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.525 1.13 . . . . 0.0 109.708 -175.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.431 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 13.7 tptm -90.3 104.61 17.17 Favored 'General case' 0 C--O 1.243 0.749 0 C-N-CA 123.239 0.615 . . . . 0.0 110.019 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.585 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 36.9 m95 -77.56 127.07 31.89 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.238 1.015 . . . . 0.0 108.937 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.555 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -64.5 -28.8 69.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -166.466 . . . . . . . . 3 3 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.17 -2.81 54.46 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 116.749 -0.205 . . . . 0.0 113.209 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.58 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 76.9 m95 -111.44 150.09 41.6 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 123.642 0.777 . . . . 0.0 110.727 -173.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -64.73 158.54 50.02 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.861 2.374 . . . . 0.0 111.836 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -62.81 -18.53 64.98 Favored 'Trans proline' 0 C--N 1.378 2.103 0 C-N-CA 123.067 2.511 . . . . 0.0 113.686 -179.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -71.55 -30.01 65.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.573 0.349 . . . . 0.0 110.511 173.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -86.36 -5.03 59.26 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.712 0.805 . . . . 0.0 111.862 176.982 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 t -68.92 123.88 22.19 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 170.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' THR . . . . . 0.402 ' HG1' ' HG2' ' A' ' 37' ' ' GLU . 17.7 p -115.87 136.74 52.75 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.119 0.967 . . . . 0.0 112.12 -165.298 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -76.5 84.92 3.21 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 172.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.471 ' HB2' HD13 ' A' ' 42' ' ' ILE . 49.1 mm-40 -101.05 140.4 21.27 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 123.358 0.663 . . . . 0.0 109.222 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -78.48 158.97 29.07 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 121.794 1.663 . . . . 0.0 111.602 174.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -54.9 -25.01 26.27 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 123.907 0.883 . . . . 0.0 112.083 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -59.3 -31.46 69.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.685 1.194 . . . . 0.0 112.077 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -127.83 25.0 6.02 Favored 'General case' 0 C--O 1.25 1.083 0 C-N-CA 123.753 0.821 . . . . 0.0 112.538 -170.198 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.581 HD13 HG22 ' A' ' 24' ' ' VAL . 37.5 mm -103.9 150.8 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 125.041 1.336 . . . . 0.0 110.293 168.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.494 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 4.9 tt -81.23 -82.57 0.12 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.225 1.01 . . . . 0.0 108.826 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -78.5 132.51 65.35 Favored Pre-proline 0 CA--C 1.559 1.31 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -80.45 -16.82 10.46 Favored 'Trans proline' 0 C--N 1.377 2.028 0 C-N-CA 122.57 2.18 . . . . 0.0 113.711 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.447 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 65.1 mtm180 -71.98 -11.12 60.62 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.866 0.866 . . . . 0.0 113.203 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.494 HD13 ' HA ' ' A' ' 9' ' ' SER . 3.1 mm? -58.7 -44.49 90.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 118.774 0.715 . . . . 0.0 109.812 167.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.37 -44.21 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.386 1.074 . . . . 0.0 110.52 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.447 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 96.0 mmm -65.25 -51.64 59.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.196 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.68 70.49 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.955 0.902 . . . . 0.0 111.547 179.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -65.92 -49.17 68.91 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.001 0.521 . . . . 0.0 110.304 175.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.17 -5.71 59.29 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.679 0.792 . . . . 0.0 112.28 -177.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 . . . . . 0 N--CA 1.481 1.083 0 C-N-CA 123.592 0.757 . . . . 0.0 110.191 168.434 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 121.112 0.482 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.2 134.31 47.65 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 171.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.54 -175.6 2.98 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 171.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . 0.523 ' HB3' HG23 ' A' ' 4' ' ' VAL . 4.5 ptp180 . . . . . 0 N--CA 1.467 0.396 0 C-N-CA 123.4 0.68 . . . . 0.0 109.591 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.689 0.281 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.9 t -100.66 140.12 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 124.189 0.995 . . . . 0.0 110.549 -177.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -142.28 163.28 33.29 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.062 0.945 . . . . 0.0 110.195 171.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.84 153.55 36.75 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.013 174.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.461 HG11 ' HB3' ' B' ' 25' ' ' ALA . 7.3 p -155.31 153.56 7.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.645 0 C-N-CA 124.311 1.045 . . . . 0.0 108.415 -176.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -121.9 -36.77 2.95 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.722 175.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -133.75 138.86 46.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.561 -166.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.8 mm -91.08 111.82 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 161.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.98 -54.19 14.38 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.708 0.63 . . . . 0.0 109.997 -173.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -139.2 176.84 8.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.823 0.849 . . . . 0.0 110.568 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -157.91 143.16 16.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.215 1.006 . . . . 0.0 108.933 -173.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -155.51 166.02 34.8 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.085 0.954 . . . . 0.0 108.582 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.4 t -127.86 114.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . 0.418 ' HD3' ' OE1' ' A' ' 21' ' ' GLU . 74.5 mtp180 -125.34 115.95 21.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 123.983 0.913 . . . . 0.0 108.92 -178.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt 64.21 24.76 13.47 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 125.458 1.503 . . . . 0.0 111.55 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.04 -16.04 60.5 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.755 -177.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.831 -0.804 . . . . 0.0 108.831 178.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 t -82.65 109.09 16.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 50.9 mt-10 -94.81 141.47 28.59 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.801 0.84 . . . . 0.0 110.279 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -120.18 120.49 36.31 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.784 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.9 tp -71.58 86.97 0.9 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.6 t -73.17 107.98 4.19 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.976 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.445 ' O ' HG21 ' A' ' 7' ' ' VAL . 20.5 tptm -78.69 99.89 6.81 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 175.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 68.0 m95 -69.94 129.67 40.12 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 175.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -20.59 62.2 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.006 0.366 . . . . 0.0 111.329 -176.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -99.05 7.46 60.47 Favored Glycine 0 C--N 1.354 1.57 0 C-N-CA 123.338 0.494 . . . . 0.0 113.626 178.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -133.7 141.1 38.78 Favored Pre-proline 0 N--CA 1.486 1.374 0 C-N-CA 123.639 0.776 . . . . 0.0 109.529 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -62.84 159.32 38.28 Favored 'Trans proline' 0 CA--C 1.565 2.031 0 C-N-CA 122.214 1.943 . . . . 0.0 110.717 168.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.22 0.56 4.41 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.083 2.522 . . . . 0.0 114.221 -174.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.568 ' HZ2' ' HB3' ' A' ' 32' ' ' LYS . 0.2 OUTLIER -77.09 -14.56 59.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.237 0.615 . . . . 0.0 111.562 170.651 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -119.27 7.25 11.24 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.663 0.785 . . . . 0.0 111.052 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.4 p -69.27 122.58 19.16 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 28.9 p -101.44 143.71 31.13 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.329 0.652 . . . . 0.0 111.314 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -76.82 86.35 3.41 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -94.5 113.08 60.1 Favored Pre-proline 0 N--CA 1.472 0.632 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 174.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.483 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 36.7 Cg_endo -64.71 172.48 6.86 Favored 'Trans proline' 0 C--N 1.371 1.728 0 C-N-CA 121.787 1.658 . . . . 0.0 113.616 175.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 11.4 pt-20 -43.75 -41.86 5.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 126.696 1.998 . . . . 0.0 114.156 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . 0.497 ' HG3' ' HG3' ' A' ' 39' ' ' GLU . 24.2 mt-10 -75.09 -29.57 60.68 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.694 1.198 . . . . 0.0 111.015 -176.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -86.46 -2.96 58.9 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.405 1.082 . . . . 0.0 112.858 -172.171 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.87 149.73 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 124.889 1.276 . . . . 0.0 110.471 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.528 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 30.5 mt -81.98 -77.62 0.22 Allowed 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 167.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -68.31 110.53 5.89 Favored Pre-proline 0 C--N 1.362 1.12 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -170.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.68 -22.7 23.75 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.425 2.083 . . . . 0.0 112.076 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . 0.574 ' HB2' ' HZ3' ' B' ' 23' ' ' LYS . 78.3 mtm180 -70.81 -14.83 62.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.597 0.759 . . . . 0.0 111.443 -177.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.6 mt -57.29 -46.51 83.08 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.713 0.805 . . . . 0.0 111.227 170.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -63.05 -53.18 49.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.754 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.455 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 1.3 mpt? -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.23 0.956 . . . . 0.0 111.141 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.4 99.43 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.956 0.902 . . . . 0.0 110.74 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -63.84 -42.24 97.64 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.175 0.99 . . . . 0.0 110.391 174.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -76.12 -10.44 59.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.758 0.823 . . . . 0.0 112.953 -174.487 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 49' ' ' MET . 52.0 mt-10 . . . . . 0 N--CA 1.489 1.523 0 C-N-CA 122.473 0.309 . . . . 0.0 110.967 172.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . 0.574 ' HZ3' ' HB2' ' A' ' 46' ' ' ARG . 27.7 mtpp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -109.63 116.23 31.35 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.925 0.49 . . . . 0.0 110.42 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.461 ' HB3' HG11 ' A' ' 7' ' ' VAL . . . -94.54 -173.33 3.0 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 167.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . 0.528 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 15.3 ttt180 . . . . . 0 C--N 1.323 -0.581 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.26 -176.127 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 . . . . . 0 CA--C 1.544 0.749 0 CA-C-O 120.7 0.286 . . . . 0.0 111.603 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.79 139.73 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.504 1.122 . . . . 0.0 108.611 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -137.79 167.61 21.37 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.777 . . . . 0.0 109.989 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.06 124.5 25.09 Favored 'General case' 0 C--O 1.248 0.974 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.519 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -110.25 145.29 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.655 0.782 . . . . 0.0 110.534 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -90.0 -46.12 8.72 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.27 1.028 . . . . 0.0 110.763 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.4 p -175.46 -170.12 0.4 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.487 0.715 . . . . 0.0 110.663 -172.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.422 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.3 mm -111.79 120.98 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 168.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.412 ' HB3' HD22 ' A' ' 23' ' ' LEU . 0.4 OUTLIER -74.31 -56.25 5.09 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.077 0.951 . . . . 0.0 109.677 -179.313 . . . . . . . . 3 3 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -137.61 176.52 8.63 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.962 0.905 . . . . 0.0 111.066 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -156.99 152.53 26.73 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.756 1.222 . . . . 0.0 108.448 -173.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -165.7 164.15 19.0 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.452 0.701 . . . . 0.0 109.723 177.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.473 HG21 HG22 ' A' ' 20' ' ' VAL . 38.6 t -108.87 126.92 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 166.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -139.0 105.77 5.38 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.413 1.085 . . . . 0.0 108.94 -170.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 62.26 26.86 16.11 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.375 1.07 . . . . 0.0 111.623 -176.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.08 -15.46 62.83 Favored Glycine 0 C--N 1.348 1.205 0 CA-C-N 115.733 -0.667 . . . . 0.0 113.175 -176.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.257 0.623 . . . . 0.0 110.009 178.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.473 HG22 HG21 ' A' ' 15' ' ' VAL . 43.7 t -76.21 104.47 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 175.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 66.3 mt-10 -98.62 149.29 22.93 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.527 0.731 . . . . 0.0 110.679 -176.014 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.422 ' HB3' HD12 ' A' ' 10' ' ' ILE . 92.8 m-85 -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.175 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . 0.412 HD22 ' HB3' ' A' ' 11' ' ' ARG . 36.4 tp -70.12 86.71 0.56 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.419 HG21 HD13 ' A' ' 42' ' ' ILE . 75.7 t -70.63 107.35 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.106 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -79.79 102.07 8.85 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.54 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.0 m95 -77.28 154.27 33.1 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.648 -177.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -76.74 -33.25 58.13 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.419 0.687 . . . . 0.0 109.662 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.26 -25.51 28.42 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.529 -0.759 . . . . 0.0 113.414 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.54 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 97.6 m95 -106.54 135.22 19.53 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-N 117.338 0.569 . . . . 0.0 111.424 -176.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -53.98 158.76 8.38 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.461 2.774 . . . . 0.0 113.098 170.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -63.68 -16.81 56.96 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 123.225 2.617 . . . . 0.0 113.621 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -79.95 -36.72 35.77 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.884 0.474 . . . . 0.0 110.858 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -83.6 -5.76 59.26 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.322 0.649 . . . . 0.0 111.37 177.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.8 m -66.58 134.73 52.95 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 169.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.7 p -120.4 159.27 25.44 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.295 0.638 . . . . 0.0 111.824 -169.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.02 84.51 6.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.928 0.891 . . . . 0.0 110.464 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -101.34 111.79 64.16 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.44 177.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 30.4 Cg_endo -61.57 165.51 13.33 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 122.135 1.89 . . . . 0.0 112.326 172.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -60.16 -21.45 61.67 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.216 1.007 . . . . 0.0 112.734 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.38 -33.04 71.89 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.249 1.02 . . . . 0.0 111.017 173.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -83.26 -29.88 28.07 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.538 -175.632 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.477 HD12 ' HB1' ' B' ' 25' ' ' ALA . 40.1 mm -88.83 144.87 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.936 0.895 . . . . 0.0 111.949 -165.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.0 mt -85.31 -72.79 0.47 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.426 0.69 . . . . 0.0 111.061 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.09 131.99 77.66 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -78.53 -18.63 12.05 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.666 2.244 . . . . 0.0 114.027 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -71.71 -13.19 61.65 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -172.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . 0.412 HD11 HG12 ' A' ' 7' ' ' VAL . 2.6 mm? -61.6 -47.38 85.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 168.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . 0.478 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 91.5 t -64.21 -46.54 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.649 176.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.2 mmt -57.82 -39.71 78.25 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.674 0.789 . . . . 0.0 111.566 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.25 85.24 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.201 1.0 . . . . 0.0 110.885 177.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . 0.416 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 68.1 t80 -73.14 -35.98 66.6 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.716 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 35.9 mm-40 -69.86 -13.1 62.1 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.193 0.597 . . . . 0.0 112.271 -175.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 . . . . . 0 N--CA 1.481 1.078 0 C-N-CA 123.583 0.753 . . . . 0.0 112.784 179.085 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 121.292 0.568 . . . . 0.0 111.598 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.82 108.02 18.67 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.804 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.477 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.06 155.42 16.81 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 163.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 . . . . . 0 C--N 1.321 -0.666 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -169.6 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 . . . . . 0 CA--C 1.548 0.887 0 CA-C-O 121.076 0.465 . . . . 0.0 111.084 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.5 t -112.47 124.84 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.389 1.076 . . . . 0.0 108.345 172.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -135.23 162.29 32.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.7 0.8 . . . . 0.0 109.623 178.078 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.91 107.06 5.09 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.448 0.699 . . . . 0.0 109.197 175.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . 0.527 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.1 p -85.43 135.0 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.09 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . 0.517 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.8 tp10 -69.11 -50.4 48.44 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.157 0.583 . . . . 0.0 109.758 175.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 p 178.76 -175.89 0.22 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.526 1.53 . . . . 0.0 108.853 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . 0.495 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -85.62 122.77 38.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.607 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.5 tmt_? -67.82 -56.05 10.63 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.337 1.055 . . . . 0.0 109.194 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.403 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.8 mttt -140.81 157.92 44.7 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.116 -176.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -139.32 143.67 37.95 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.269 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -169.04 138.1 2.1 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.902 0.751 . . . . 0.0 109.924 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -86.16 124.28 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -127.07 105.2 8.42 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.483 1.113 . . . . 0.0 109.156 -173.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 59.51 32.95 22.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.57 1.148 . . . . 0.0 111.087 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.92 2.65 83.85 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.588 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . 0.513 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -107.14 111.63 24.14 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.444 0.698 . . . . 0.0 109.827 174.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 t -74.18 110.52 8.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -93.7 144.04 25.76 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.156 0.982 . . . . 0.0 109.386 -173.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . 0.495 ' HB3' HD12 ' A' ' 10' ' ' ILE . 94.6 m-85 -128.86 109.36 11.2 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.617 0.767 . . . . 0.0 109.097 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.8 tp -67.36 97.11 0.54 Allowed 'General case' 0 C--N 1.345 0.388 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.1 t -76.47 105.93 5.86 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 C-N-CA 123.768 0.827 . . . . 0.0 110.131 -173.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.607 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.1 tptp -82.24 100.12 9.7 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.645 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 46.2 m95 -69.04 140.64 54.94 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . 0.517 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.8 ttpt -59.98 -50.84 72.16 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 123.585 0.553 . . . . 0.0 111.874 -172.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.85 -28.41 31.81 Favored Glycine 0 C--N 1.341 0.819 0 CA-C-N 115.921 -0.581 . . . . 0.0 113.343 -177.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.645 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 58.1 m95 -89.26 123.83 66.12 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.713 0.405 . . . . 0.0 110.147 -175.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 72.4 Cg_exo -53.76 164.92 2.05 Favored 'Trans proline' 0 C--N 1.38 2.205 0 C-N-CA 123.645 2.897 . . . . 0.0 113.979 174.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.75 -23.56 33.96 Favored 'Trans proline' 0 C--N 1.387 2.584 0 C-N-CA 123.674 2.916 . . . . 0.0 114.855 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . 0.471 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.4 pttt -66.3 -33.0 74.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.227 0.611 . . . . 0.0 112.124 176.021 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . 0.449 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 75.0 m-85 -91.35 -13.39 32.6 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.274 0.63 . . . . 0.0 111.544 176.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.8 m -66.92 130.77 44.23 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.0 p -119.47 145.04 46.64 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.477 0.711 . . . . 0.0 111.164 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -76.2 79.51 3.0 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.575 0.75 . . . . 0.0 110.252 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -93.18 113.67 60.64 Favored Pre-proline 0 C--O 1.236 0.373 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 175.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.59 178.5 4.41 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.595 1.53 . . . . 0.0 113.271 -178.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -38.18 -42.71 0.7 Allowed 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 127.186 2.194 . . . . 0.0 115.214 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.91 -20.67 52.44 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.517 0.727 . . . . 0.0 111.995 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -112.73 16.78 19.5 Favored 'General case' 0 C--O 1.253 1.276 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -164.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 32.3 mm -101.69 152.64 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 125.474 1.51 . . . . 0.0 109.213 172.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.4 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 91.1 mt -83.45 -73.89 0.39 Allowed 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.08 0.4 . . . . 0.0 110.817 176.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.79 118.3 70.02 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.0 -19.92 26.07 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.557 2.171 . . . . 0.0 112.724 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -10.08 59.25 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.326 178.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -49.14 -42.04 38.25 Favored 'General case' 0 N--CA 1.507 2.392 0 CA-C-N 119.248 0.931 . . . . 0.0 110.412 167.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -51.57 57.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.918 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mmt -55.27 -42.36 73.46 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.856 0.862 . . . . 0.0 111.49 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.65 -39.43 88.22 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.871 1.268 . . . . 0.0 111.339 -175.892 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.68 -46.76 35.76 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.47 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -68.71 -6.3 25.46 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.449 0.7 . . . . 0.0 112.793 -170.957 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 . . . . . 0 CA--C 1.556 1.181 0 C-N-CA 123.524 0.73 . . . . 0.0 112.006 168.78 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp . . . . . 0 N--CA 1.48 1.046 0 CA-C-O 120.914 0.387 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.18 125.77 53.8 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.31 0.644 . . . . 0.0 110.117 174.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.59 175.51 9.1 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 124.189 0.996 . . . . 0.0 108.508 171.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . 0.4 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 45.0 ttp180 . . . . . 0 C--O 1.235 0.315 0 C-N-CA 123.065 0.546 . . . . 0.0 110.706 -173.455 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.3 t -116.67 140.8 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.963 1.305 . . . . 0.0 108.584 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -141.31 158.63 43.63 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.53 0.732 . . . . 0.0 110.373 171.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.75 114.87 11.36 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.588 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -87.27 138.76 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.345 1.058 . . . . 0.0 110.249 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -76.28 -57.4 3.89 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 122.922 0.489 . . . . 0.0 109.821 175.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.0 m -157.16 170.95 21.33 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.013 0.925 . . . . 0.0 110.16 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.2 mm -89.28 110.9 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 162.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.51 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.6 tmt_? -66.37 -58.46 5.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.348 1.059 . . . . 0.0 109.198 -177.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' LYS . . . . . 0.471 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.5 mtpp -137.58 170.88 15.31 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.774 0.83 . . . . 0.0 111.444 -177.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -156.68 129.4 7.7 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.432 1.093 . . . . 0.0 108.898 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -157.84 150.72 22.94 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.682 0.793 . . . . 0.0 109.235 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' VAL . . . . . 0.456 HG23 HG21 ' A' ' 20' ' ' VAL . 47.2 t -93.43 112.68 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 173.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -107.2 96.83 6.7 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.761 1.224 . . . . 0.0 108.751 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.3 tptt 62.11 49.28 4.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.645 1.178 . . . . 0.0 110.938 176.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 81.82 -18.28 12.94 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.677 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -86.68 110.54 19.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.005 0.922 . . . . 0.0 109.57 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' VAL . . . . . 0.456 HG21 HG23 ' A' ' 15' ' ' VAL . 21.4 t -78.71 103.75 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -98.41 144.95 27.22 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.235 1.014 . . . . 0.0 110.554 -173.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -126.32 119.92 28.59 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.089 0.956 . . . . 0.0 108.602 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.3 tp -70.72 90.81 0.79 Allowed 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 169.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.492 HG22 HD11 ' A' ' 42' ' ' ILE . 63.7 t -78.02 105.26 6.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 123.697 0.799 . . . . 0.0 109.95 -173.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.4 tptp -77.41 103.55 7.4 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.45 0.7 . . . . 0.0 109.14 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' TRP . . . . . 0.508 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -77.04 157.32 31.2 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 110.111 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -64.55 -41.98 95.98 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.931 0.492 . . . . 0.0 111.098 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.0 -24.39 35.08 Favored Glycine 0 C--N 1.346 1.098 0 CA-C-N 115.935 -0.575 . . . . 0.0 113.597 -177.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' TRP . . . . . 0.508 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 77.0 m95 -104.45 124.59 36.67 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 122.906 0.482 . . . . 0.0 111.055 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -52.98 163.66 1.99 Allowed 'Trans proline' 0 C--N 1.386 2.524 0 C-N-CA 124.056 3.17 . . . . 0.0 113.363 171.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -62.84 -26.64 74.77 Favored 'Trans proline' 0 C--N 1.385 2.497 0 C-N-CA 123.08 2.52 . . . . 0.0 113.448 -174.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -78.47 -26.25 46.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.069 0.548 . . . . 0.0 111.278 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -92.75 2.11 56.92 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.838 0.855 . . . . 0.0 111.391 175.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.0 m -76.3 155.73 34.0 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.369 0.667 . . . . 0.0 110.347 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.3 p -115.35 135.43 54.14 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.258 0.623 . . . . 0.0 112.481 -171.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -74.95 82.49 2.2 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.91 0.884 . . . . 0.0 110.286 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -106.06 123.07 40.26 Favored Pre-proline 0 N--CA 1.465 0.299 0 C-N-CA 123.751 0.82 . . . . 0.0 109.432 178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' PRO . . . . . 0.525 ' O ' HG12 ' A' ' 42' ' ' ILE . 38.3 Cg_endo -64.19 165.05 20.6 Favored 'Trans proline' 0 C--N 1.368 1.6 0 C-N-CA 122.361 2.04 . . . . 0.0 112.15 173.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -56.43 -27.92 57.97 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.192 0.997 . . . . 0.0 111.021 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -55.5 -45.26 77.06 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.604 1.561 . . . . 0.0 111.226 169.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 42.5 m170 -88.13 -7.29 57.15 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.066 0.946 . . . . 0.0 113.169 -176.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' ILE . . . . . 0.602 HD13 ' HB1' ' B' ' 25' ' ' ALA . 41.8 mm -94.26 139.22 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.814 0.846 . . . . 0.0 109.833 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' LEU . . . . . 0.563 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 94.9 mt -71.48 -64.76 0.86 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.833 0.453 . . . . 0.0 110.078 175.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.69 109.99 22.04 Favored Pre-proline 0 CA--C 1.556 1.184 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.161 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.8 -9.89 19.78 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.782 2.321 . . . . 0.0 112.704 -176.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 -72.89 -12.63 61.04 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.311 0.644 . . . . 0.0 111.341 -176.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.89 -43.38 86.07 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.914 0.486 . . . . 0.0 110.975 169.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.6 t -64.81 -42.05 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.693 0.797 . . . . 0.0 109.938 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' MET . . . . . 0.401 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 24.7 mmt -60.36 -47.49 85.81 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.276 177.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.9 80.4 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.507 1.123 . . . . 0.0 111.565 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -68.08 -34.08 75.75 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.89 0.876 . . . . 0.0 110.774 176.005 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -90.79 -9.06 47.95 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.932 0.493 . . . . 0.0 111.881 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 49' ' ' MET . 30.0 mm-40 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 122.933 0.493 . . . . 0.0 110.02 171.456 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.991 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 . . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -113.76 112.02 22.73 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.423 0.63 . . . . 0.0 110.63 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 25' ' ' ALA . . . . . 0.602 ' HB1' HD13 ' A' ' 42' ' ' ILE . . . -85.87 168.94 13.77 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.464 165.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' B' B ' 26' ' ' ARG . . . . . 0.563 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 23.1 ttt180 . . . . . 0 N--CA 1.471 0.611 0 CA-C-O 121.488 0.661 . . . . 0.0 111.289 -175.096 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.803 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -145.58 176.31 9.71 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.95 0.9 . . . . 0.0 110.659 -171.641 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.63 ' HB2' ' HB2' ' B' ' 27' ' ' M3L . 1.3 mp0 -82.08 81.73 7.92 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.624 0.77 . . . . 0.0 109.593 -174.695 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 71.3 t -82.51 120.8 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 109.622 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.426 ' HE2' ' HB3' ' A' ' 3' ' ' GLN . 86.8 m-85 -137.14 161.91 34.85 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.736 0.814 . . . . 0.0 109.676 178.367 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.89 129.87 37.64 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 174.654 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.413 HG12 HD12 ' A' ' 47' ' ' LEU . 2.7 p -111.25 143.11 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.507 1.123 . . . . 0.0 110.418 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.0 -58.99 2.96 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.468 1.107 . . . . 0.0 109.378 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.9 p -174.14 -172.28 0.69 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.402 1.081 . . . . 0.0 109.775 -176.141 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.42 HD12 ' HB3' ' A' ' 22' ' ' TYR . 48.2 mm -98.01 120.07 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.558 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.49 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -73.68 -53.93 9.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.127 0.971 . . . . 0.0 109.552 179.812 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.445 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 99.0 mttt -138.05 174.45 10.55 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.916 0.886 . . . . 0.0 111.342 -176.508 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -154.55 144.79 21.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.35 1.06 . . . . 0.0 108.724 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -161.45 -179.2 7.16 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.984 0.914 . . . . 0.0 109.538 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 41.2 t -135.14 118.76 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -136.83 129.85 30.95 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.333 1.053 . . . . 0.0 109.274 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm 62.68 24.92 14.84 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.994 0.918 . . . . 0.0 111.63 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.04 -8.44 60.42 Favored Glycine 0 C--N 1.352 1.424 0 CA-C-N 115.816 -0.629 . . . . 0.0 113.232 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -85.87 117.99 25.07 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 123.84 0.856 . . . . 0.0 108.935 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.7 t -79.09 104.8 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -97.68 139.08 34.11 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.946 0.898 . . . . 0.0 110.139 -170.596 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.42 ' HB3' HD12 ' A' ' 10' ' ' ILE . 15.1 m-85 -118.13 121.3 40.18 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.0 tp -74.8 94.64 2.79 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 172.51 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.8 t -76.69 105.98 6.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.622 0.769 . . . . 0.0 109.97 -174.828 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.49 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.0 tptp -81.65 106.92 13.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.053 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.598 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 77.4 m95 -77.16 149.97 35.56 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.571 0.748 . . . . 0.0 110.787 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -77.44 -34.06 54.63 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.076 0.55 . . . . 0.0 111.322 -174.131 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.51 15.31 42.13 Favored Glycine 0 C--N 1.343 0.944 0 CA-C-N 116.229 -0.442 . . . . 0.0 113.008 -178.684 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.598 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 88.8 m95 -133.48 136.83 27.69 Favored Pre-proline 0 C--O 1.246 0.887 0 C-N-CA 123.125 0.57 . . . . 0.0 110.067 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.415 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 88.4 Cg_exo -52.21 158.05 5.72 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 123.355 2.704 . . . . 0.0 113.333 167.965 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.42 5.54 1.53 Allowed 'Trans proline' 0 C--N 1.377 2.049 0 C-N-CA 123.406 2.737 . . . . 0.0 114.603 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.415 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.0 pttt -90.03 -15.88 30.91 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.779 0.431 . . . . 0.0 110.923 170.106 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.408 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 97.7 m-85 -96.32 -2.6 45.47 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.54 0.736 . . . . 0.0 111.441 174.298 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -63.53 122.52 16.49 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.069 0.547 . . . . 0.0 110.727 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.41 ' HG1' ' HG2' ' A' ' 37' ' ' GLU . 13.8 p -102.43 135.91 43.21 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.74 0.816 . . . . 0.0 111.366 -172.057 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -76.33 75.37 3.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.276 0.63 . . . . 0.0 109.494 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.41 ' HG2' ' HG1' ' A' ' 35' ' ' THR . 66.4 mm-40 -90.65 117.95 68.33 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.521 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.19 169.16 15.78 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 121.996 1.797 . . . . 0.0 111.756 173.776 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -50.11 -39.41 42.78 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.985 1.314 . . . . 0.0 114.378 -171.579 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.78 -1.47 54.33 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 27.3 m-70 -115.72 14.19 16.35 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.881 0.873 . . . . 0.0 111.236 178.61 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 28.9 mm -103.42 150.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 126.11 1.764 . . . . 0.0 109.541 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.443 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 5.6 tt -89.44 -79.47 0.33 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.3 t70 -80.66 126.63 77.71 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -80.45 -13.7 12.07 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.755 2.304 . . . . 0.0 114.247 -175.553 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -15.11 62.74 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.387 0.675 . . . . 0.0 112.74 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.413 HD12 HG12 ' A' ' 7' ' ' VAL . 3.9 mm? -58.42 -53.27 60.19 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 118.335 0.516 . . . . 0.0 111.715 178.573 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.14 -32.53 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.876 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.488 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmt -62.4 -52.34 63.97 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 175.452 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.25 72.24 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.494 1.118 . . . . 0.0 111.58 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -62.82 -47.37 83.71 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.206 1.003 . . . . 0.0 110.928 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.34 -9.9 59.29 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.488 ' HG2' ' O ' ' A' ' 49' ' ' MET . 27.3 mm-40 -63.6 -31.02 72.06 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-O 120.942 0.401 . . . . 0.0 110.447 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -95.45 -23.17 17.25 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.168 0.987 . . . . 0.0 110.708 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -65.73 140.47 58.45 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.728 0.811 . . . . 0.0 111.061 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 123.799 0.84 . . . . 0.0 109.245 178.703 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 97.1 mt -85.26 85.42 7.46 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -87.06 126.33 34.69 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.132 177.599 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.0 t -73.29 82.45 1.37 Allowed 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 122.413 1.102 . . . . 0.0 109.353 172.819 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -118.34 148.1 42.83 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 114.312 -1.313 . . . . 0.0 109.395 -176.876 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -130.15 127.4 39.67 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.076 0.951 . . . . 0.0 108.824 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.91 -174.0 2.36 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.48 ' HD3' ' OG ' ' B' ' 28' ' ' SER . 9.7 ptp180 -145.0 158.08 43.93 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.47 0.708 . . . . 0.0 109.837 -176.162 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.63 ' HB2' ' HB2' ' A' ' 3' ' ' GLN . . . . . . . . 0 C--O 1.245 0.863 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 169.486 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.48 ' OG ' ' HD3' ' B' ' 26' ' ' ARG . 48.3 m -75.44 -13.73 60.4 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.442 173.04 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . 70.7 131.63 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.834 1.654 . . . . 0.0 112.44 174.166 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -60.39 -29.16 88.19 Favored 'Trans proline' 0 C--N 1.377 2.061 0 C-N-CA 122.398 2.065 . . . . 0.0 111.721 167.904 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -105.03 98.69 8.36 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.379 1.072 . . . . 0.0 109.632 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.1 t -155.36 139.36 16.37 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.776 0.831 . . . . 0.0 109.905 -178.634 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.198 0 CA-C-O 119.173 -0.793 . . . . 0.0 111.891 -179.246 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -123.24 93.33 3.92 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.62 0.768 . . . . 0.0 108.966 -179.036 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -152.0 102.35 2.8 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.336 0.654 . . . . 0.0 109.686 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 t -109.68 144.32 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 124.273 1.029 . . . . 0.0 108.612 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.538 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 72.8 m-85 -128.97 160.73 31.77 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 167.201 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.48 114.13 10.27 Favored 'General case' 0 C--O 1.242 0.673 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 166.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.408 HG12 ' O ' ' B' ' 23' ' ' LYS . 3.1 p -92.95 137.88 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.083 0.553 . . . . 0.0 111.331 -172.054 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.644 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.8 tt0 -63.12 -59.56 4.61 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.714 0.806 . . . . 0.0 109.496 174.487 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.3 p -176.73 176.53 1.5 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-N 113.621 -1.627 . . . . 0.0 108.844 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.495 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.4 mm -82.95 115.6 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -53.56 18.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.184 0.594 . . . . 0.0 110.279 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -133.96 166.32 22.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.565 0.746 . . . . 0.0 110.566 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -151.06 142.2 23.15 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -154.42 173.23 16.52 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.447 0.699 . . . . 0.0 109.318 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.03 125.03 9.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.966 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.3 ptt180 -139.9 122.22 15.99 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.651 0.78 . . . . 0.0 109.296 178.489 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 62.62 26.45 15.68 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.853 1.261 . . . . 0.0 110.667 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.46 -8.01 80.49 Favored Glycine 0 C--N 1.354 1.543 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.712 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.4 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 70.2 mmtt -89.77 112.96 24.42 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 117.252 0.526 . . . . 0.0 110.858 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.2 t -89.36 108.33 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.37 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 51.4 mt-10 -96.76 155.73 16.65 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.243 0.617 . . . . 0.0 110.738 -177.772 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.495 ' HB3' HD12 ' A' ' 10' ' ' ILE . 66.2 m-85 -132.99 112.22 11.66 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.142 0.977 . . . . 0.0 108.693 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.26 90.58 0.5 Allowed 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.617 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.26 106.91 4.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.521 0.728 . . . . 0.0 111.305 -173.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -82.8 107.25 15.29 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.538 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 52.9 m95 -71.45 149.25 46.06 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.853 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.644 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 26.7 ttpp -67.48 -65.43 0.69 Allowed 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.319 0.648 . . . . 0.0 112.614 -166.102 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.21 41.07 2.72 Favored Glycine 0 N--CA 1.467 0.763 0 CA-C-N 116.583 -0.28 . . . . 0.0 112.759 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.502 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.7 m95 -139.57 133.97 16.03 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 123.715 0.806 . . . . 0.0 109.385 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -59.71 157.31 33.22 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 122.775 2.317 . . . . 0.0 112.374 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.55 -15.23 19.32 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 124.046 3.164 . . . . 0.0 115.328 -172.754 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.52 -25.19 67.88 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -87.39 -5.1 59.0 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.463 0.705 . . . . 0.0 112.619 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.1 p -66.6 125.83 27.0 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.462 ' HG1' ' HG2' ' A' ' 37' ' ' GLU . 21.4 p -118.36 135.91 54.05 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.692 0.797 . . . . 0.0 110.904 -173.239 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -68.81 85.4 0.32 Allowed 'General case' 0 C--N 1.356 0.874 0 C-N-CA 123.276 0.63 . . . . 0.0 109.389 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HG2' ' HG1' ' A' ' 35' ' ' THR . 45.9 mm-40 -100.64 102.83 20.63 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.059 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.438 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 41.0 Cg_endo -62.91 178.92 0.86 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 122.513 2.142 . . . . 0.0 113.234 173.8 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -59.13 -24.19 62.79 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.8 mp0 -73.84 -23.18 59.6 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.175 0.59 . . . . 0.0 111.979 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -94.56 -19.27 20.65 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -168.241 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.43 HG22 ' HA ' ' B' ' 25' ' ' ALA . 33.2 mm -90.81 149.36 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.76 0.824 . . . . 0.0 110.613 -174.17 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -86.34 -71.94 0.52 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.214 0.606 . . . . 0.0 109.617 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -72.03 126.68 91.2 Favored Pre-proline 0 CA--C 1.562 1.407 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.533 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -76.43 -23.23 11.71 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.575 2.183 . . . . 0.0 113.796 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 88.8 mtm180 -69.87 -12.83 61.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.33 1.052 . . . . 0.0 113.59 -168.95 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.436 ' HB3' HG12 ' A' ' 10' ' ' ILE . 3.0 mm? -57.31 -40.63 78.26 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 118.116 0.416 . . . . 0.0 110.693 171.525 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.63 -43.95 93.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.059 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.422 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 1.5 mpt? -61.95 -50.58 71.56 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.589 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.32 -34.97 74.55 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.283 1.033 . . . . 0.0 111.797 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.34 -39.69 94.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.039 0.936 . . . . 0.0 110.926 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -87.15 -10.68 52.1 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.735 0.814 . . . . 0.0 111.942 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 49' ' ' MET . 41.0 mm-40 -77.9 -34.93 51.25 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 122.856 0.463 . . . . 0.0 110.785 175.025 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -83.07 -177.67 6.84 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.878 0.471 . . . . 0.0 110.615 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -77.11 109.83 11.27 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.371 0.669 . . . . 0.0 109.459 175.945 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.562 1.433 0 C-N-CA 124.476 1.111 . . . . 0.0 109.832 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 . . . . . 0 N--CA 1.483 1.182 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 52.9 tp 62.95 93.83 0.05 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.841 1.256 . . . . 0.0 109.88 -176.188 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -144.59 131.38 20.17 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.455 0.702 . . . . 0.0 109.54 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 12.3 t -80.34 135.5 36.21 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.551 0.691 . . . . 0.0 110.85 -177.733 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . 0.408 ' O ' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -112.98 -174.04 2.37 Favored 'General case' 0 C--O 1.247 0.97 0 C-N-CA 124.359 1.064 . . . . 0.0 108.694 176.056 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -102.03 104.3 14.95 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.164 0.506 . . . . 0.0 110.647 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.43 ' HA ' HG22 ' A' ' 42' ' ' ILE . . . -103.85 142.34 34.57 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 164.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -132.21 149.99 52.26 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.104 0.561 . . . . 0.0 110.092 -172.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.429 HM23 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.539 0.555 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.028 171.409 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 12.7 t 76.45 161.08 0.23 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.346 1.058 . . . . 0.0 112.947 168.633 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . 66.36 90.24 0.09 OUTLIER Pre-proline 0 N--CA 1.483 1.204 0 C-N-CA 125.213 1.405 . . . . 0.0 110.876 -176.955 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -73.95 95.8 0.91 Allowed 'Trans proline' 0 C--N 1.374 1.87 0 C-N-CA 122.371 2.047 . . . . 0.0 111.478 -179.197 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.06 95.33 0.38 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.209 0.604 . . . . 0.0 110.615 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 26.5 m -72.07 114.89 10.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.473 0.709 . . . . 0.0 111.518 -176.519 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.811 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 179.616 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.419 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.526 ' HB2' ' HD2' ' B' ' 26' ' ' ARG . 15.2 pt-20 -81.83 97.62 8.09 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.453 0.644 . . . . 0.0 109.534 178.101 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.472 ' HB2' ' HB2' ' B' ' 27' ' ' M3L . 83.8 mt-30 -82.45 79.34 8.92 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.493 0.717 . . . . 0.0 110.635 -175.592 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 46.0 t -83.65 125.01 40.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.482 1.113 . . . . 0.0 109.512 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 68.8 m-85 -133.44 147.01 51.68 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.937 0.495 . . . . 0.0 110.421 176.952 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.66 111.32 4.73 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.1 p -89.37 144.14 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.685 0.794 . . . . 0.0 110.736 -176.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -81.92 -61.19 1.99 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.739 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.6 m -158.35 171.58 19.91 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.937 0.895 . . . . 0.0 110.221 -174.7 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.47 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 34.7 mm -92.81 117.5 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 163.534 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.01 -46.91 27.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.944 0.898 . . . . 0.0 109.887 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -151.65 166.1 32.3 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.532 0.733 . . . . 0.0 109.765 -176.61 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -146.97 152.21 38.26 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.242 1.017 . . . . 0.0 109.68 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -165.15 167.69 17.91 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.367 1.467 . . . . 0.0 108.526 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.443 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 13.6 p -118.42 145.35 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 172.898 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -142.81 96.02 2.87 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.178 0.591 . . . . 0.0 109.602 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm 55.96 39.19 30.58 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.546 1.138 . . . . 0.0 111.554 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.48 -19.51 52.2 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.752 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -85.75 108.29 18.01 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.661 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.443 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 11.3 t -85.9 109.77 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -175.29 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -93.82 136.53 34.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.896 0.878 . . . . 0.0 109.657 -170.38 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -124.48 122.79 38.61 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -71.63 85.87 0.89 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 170.009 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.592 HG23 HD12 ' A' ' 42' ' ' ILE . 65.8 t -77.43 107.03 8.35 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.741 -173.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -74.54 102.84 4.65 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.233 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.598 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.7 m95 -74.18 138.0 43.49 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.498 177.132 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -77.95 -17.9 56.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.008 0.523 . . . . 0.0 111.35 -172.223 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.37 13.76 28.08 Favored Glycine 0 C--N 1.346 1.116 0 C-N-CA 123.107 0.384 . . . . 0.0 112.994 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.598 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.2 m95 -130.88 147.16 65.14 Favored Pre-proline 0 N--CA 1.482 1.173 0 C-N-CA 123.592 0.757 . . . . 0.0 110.537 178.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -55.13 157.26 14.12 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.212 2.608 . . . . 0.0 113.254 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -63.92 -16.74 56.6 Favored 'Trans proline' 0 C--N 1.384 2.409 0 C-N-CA 123.122 2.548 . . . . 0.0 113.338 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.67 -27.94 30.98 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.009 0.524 . . . . 0.0 111.465 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -86.76 -1.43 57.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.628 0.771 . . . . 0.0 111.174 175.557 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.6 m -67.11 117.99 9.91 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 170.362 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.54 HG22 HM12 ' B' ' 27' ' ' M3L . 23.0 p -106.58 151.66 24.73 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.361 0.664 . . . . 0.0 111.269 -172.505 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -79.19 89.28 4.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.281 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -100.45 119.1 59.76 Favored Pre-proline 0 C--O 1.239 0.53 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.47 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.41 ' HA ' ' O ' ' A' ' 20' ' ' VAL . 61.0 Cg_endo -69.46 171.23 14.5 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.296 1.998 . . . . 0.0 112.073 173.637 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -61.9 -19.45 62.68 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.654 0.782 . . . . 0.0 112.13 177.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.487 ' O ' ' HD3' ' B' ' 30' ' ' PRO . 30.5 tt0 -56.88 -46.59 81.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.993 0.917 . . . . 0.0 110.224 168.997 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.8 m170 -85.47 -25.23 27.03 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.666 -172.835 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.592 HD12 HG23 ' A' ' 24' ' ' VAL . 48.1 mm -81.84 146.21 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.599 0.76 . . . . 0.0 111.624 -174.69 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.1 mt -86.47 -61.92 1.63 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.678 0.791 . . . . 0.0 110.098 173.029 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -72.55 112.68 15.93 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 123.397 0.679 . . . . 0.0 110.161 -172.592 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.49 -24.49 7.59 Favored 'Trans proline' 0 C--N 1.374 1.873 0 C-N-CA 122.582 2.188 . . . . 0.0 112.582 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -72.89 -21.15 60.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.271 1.028 . . . . 0.0 109.71 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 44.5 tp -55.22 -48.64 73.6 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.354 1.461 . . . . 0.0 112.234 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t -68.92 -36.03 72.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.216 -177.505 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.405 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 92.6 mmm -55.86 -45.51 78.48 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.086 0.866 . . . . 0.0 110.666 178.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.58 -33.43 63.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.964 0.905 . . . . 0.0 112.454 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.47 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 86.1 t80 -75.44 -46.03 35.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.113 0.965 . . . . 0.0 110.389 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.53 -11.89 61.1 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.652 0.781 . . . . 0.0 112.899 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.405 ' HG2' ' O ' ' A' ' 49' ' ' MET . 11.0 mm-40 -58.44 -32.25 68.53 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.323 0.582 . . . . 0.0 109.821 172.645 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.5 108.0 19.17 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 173.043 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 66.92 81.14 0.2 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.42 1.488 . . . . 0.0 111.086 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 CA--C 1.558 1.288 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.761 179.646 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 55.3 tp -78.39 144.74 35.65 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.379 0.672 . . . . 0.0 109.731 176.792 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.29 119.42 5.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.197 0.599 . . . . 0.0 110.536 -177.458 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 26.9 m -87.33 86.84 7.29 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 175.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtpt -109.05 146.81 33.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.18 0.992 . . . . 0.0 108.661 -176.573 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -119.91 113.09 20.03 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 122.897 0.479 . . . . 0.0 110.232 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.453 ' HB2' HD11 ' A' ' 42' ' ' ILE . . . -96.4 172.66 7.8 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 169.486 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.526 ' HD2' ' HB2' ' A' ' 2' ' ' GLU . 49.7 ttp180 -152.59 158.09 41.96 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 -175.426 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.54 HM12 HG22 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.537 0.473 0 C-N-CA 123.639 0.776 . . . . 0.0 111.319 178.072 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 13.6 m -140.76 135.56 31.64 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 122.038 -0.414 . . . . 0.0 111.701 -167.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.56 154.48 94.44 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 124.13 0.972 . . . . 0.0 111.076 176.39 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . 0.487 ' HD3' ' O ' ' A' ' 40' ' ' GLU . 38.7 Cg_exo -60.12 112.76 1.4 Allowed 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 123.038 2.492 . . . . 0.0 112.237 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.97 106.65 1.29 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.812 0.845 . . . . 0.0 110.858 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 15.4 t -155.86 21.87 0.39 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.08 0.952 . . . . 0.0 110.231 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.02 0 CA-C-O 118.91 -0.939 . . . . 0.0 111.512 -179.01 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.312 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -86.86 6.05 33.76 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.848 0.859 . . . . 0.0 111.806 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -60.98 118.45 6.74 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.395 0.678 . . . . 0.0 112.174 -175.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.9 t -102.15 121.36 53.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 125.022 1.329 . . . . 0.0 107.978 172.631 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.419 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 52.4 m-85 -127.13 155.09 43.89 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 118.065 0.393 . . . . 0.0 110.338 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.97 114.75 6.78 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.82 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.423 HG13 HD13 ' A' ' 47' ' ' LEU . 4.1 p -103.97 137.52 32.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 C-N-CA 124.116 0.967 . . . . 0.0 111.073 -173.053 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.592 ' HA ' ' HB1' ' B' ' 21' ' ' ALA . 32.0 tt0 -74.87 -63.03 1.35 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.924 -177.554 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -165.48 -177.65 4.54 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.941 0.896 . . . . 0.0 110.385 -173.037 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.541 HD13 ' HB3' ' A' ' 22' ' ' TYR . 49.9 mm -86.95 109.68 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 169.301 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.63 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -68.76 -49.62 57.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.848 1.259 . . . . 0.0 109.408 -178.316 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -146.03 168.96 19.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.407 1.083 . . . . 0.0 109.788 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -155.18 138.73 15.97 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.969 0.908 . . . . 0.0 108.897 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -165.56 139.78 4.7 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.64 0.776 . . . . 0.0 109.714 174.532 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.97 118.63 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 CA-C-O 121.256 0.55 . . . . 0.0 110.625 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -107.53 101.3 10.64 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.022 0.929 . . . . 0.0 109.615 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 59.45 40.96 20.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.065 1.346 . . . . 0.0 112.642 174.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.81 -17.64 57.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-N 115.533 -0.758 . . . . 0.0 113.232 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -90.49 110.92 22.03 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.3 t -81.82 111.4 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -93.78 137.94 32.5 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 123.913 0.885 . . . . 0.0 109.474 -173.148 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.541 ' HB3' HD13 ' A' ' 10' ' ' ILE . 72.6 m-85 -121.61 114.73 21.59 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.507 HD21 ' HD2' ' A' ' 11' ' ' ARG . 23.6 tp -70.55 93.62 0.92 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 170.273 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 73.5 t -70.73 105.84 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 124.659 1.184 . . . . 0.0 110.571 -175.882 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.63 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 21.0 tptm -78.63 101.06 7.27 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 172.891 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.5 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 74.1 m95 -69.09 141.23 54.78 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 173.753 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -76.65 -39.56 51.86 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.95 -47.96 35.89 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.212 178.339 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.5 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.9 m95 -87.24 136.31 33.76 Favored Pre-proline 0 N--CA 1.479 0.994 0 C-N-CA 123.455 0.702 . . . . 0.0 110.491 -177.987 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -60.42 164.05 13.83 Favored 'Trans proline' 0 CA--C 1.569 2.262 0 C-N-CA 123.081 2.521 . . . . 0.0 112.034 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.53 -19.33 13.41 Favored 'Trans proline' 0 C--N 1.39 2.744 0 C-N-CA 124.059 3.173 . . . . 0.0 115.562 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -71.58 -27.51 63.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.634 0.374 . . . . 0.0 111.991 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.409 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 67.6 m-85 -97.19 12.39 33.0 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.425 0.69 . . . . 0.0 111.857 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -64.77 122.77 17.67 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 173.841 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.409 ' HG1' ' HG2' ' A' ' 37' ' ' GLU . 24.7 p -101.55 128.8 47.63 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.877 0.871 . . . . 0.0 111.005 -173.716 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -68.8 83.49 0.3 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 171.811 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.491 ' HB3' ' HB2' ' A' ' 41' ' ' HIS . 29.0 mm-40 -106.85 116.82 58.07 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.994 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.1 174.96 5.23 Favored 'Trans proline' 0 C--N 1.362 1.243 0 C-N-CA 122.064 1.843 . . . . 0.0 111.421 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -56.84 -19.07 15.44 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.495 1.118 . . . . 0.0 112.858 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.73 -22.89 62.68 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.127 1.371 . . . . 0.0 112.078 173.608 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.491 ' HB2' ' HB3' ' A' ' 37' ' ' GLU . 66.8 m-70 -117.04 -16.47 10.48 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.149 0.98 . . . . 0.0 112.176 -174.094 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mm -82.26 140.92 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 122.905 0.482 . . . . 0.0 110.626 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.5 mt -87.91 -70.73 0.61 Allowed 'General case' 0 C--N 1.351 0.655 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.74 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -72.73 126.63 90.59 Favored Pre-proline 0 CA--C 1.557 1.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -80.13 -17.6 10.45 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.865 2.377 . . . . 0.0 113.828 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.634 ' HA ' ' HG2' ' A' ' 49' ' ' MET . 87.1 mtm180 -69.82 -16.38 63.26 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.247 0.619 . . . . 0.0 111.887 -173.866 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.423 HD13 HG13 ' A' ' 7' ' ' VAL . 4.3 mm? -58.02 -53.75 54.68 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.346 0.658 . . . . 0.0 110.457 172.263 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.7 t -70.69 -53.06 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 114.515 -1.221 . . . . 0.0 109.85 -171.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.634 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 25.6 ptm -59.18 -33.34 70.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.722 0.639 . . . . 0.0 112.086 -174.998 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.97 -49.56 74.24 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -66.13 -30.95 71.54 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.004 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -74.97 -18.88 60.31 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.788 0.835 . . . . 0.0 111.586 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -77.12 -10.59 59.49 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.94 0.496 . . . . 0.0 111.544 173.666 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.15 175.08 9.81 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.055 0.542 . . . . 0.0 111.174 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -131.75 100.42 5.1 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 166.602 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 123.506 0.722 . . . . 0.0 111.014 -174.133 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 . . . . . 0 N--CA 1.476 0.837 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.47 167.39 21.99 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 122.906 0.483 . . . . 0.0 110.397 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.592 ' HB1' ' HA ' ' A' ' 8' ' ' GLU . . . -91.22 19.64 5.74 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.579 0.752 . . . . 0.0 111.771 -179.269 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 18.6 m -87.08 67.62 9.77 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 122.277 1.037 . . . . 0.0 110.579 -177.964 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.07 161.81 36.73 Favored 'General case' 0 C--O 1.243 0.76 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 171.903 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -127.55 123.8 36.68 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 111.297 -176.757 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.92 168.42 10.31 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 167.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -141.53 166.22 25.36 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -176.007 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.778 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.841 175.908 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 25.0 p 178.1 147.47 0.15 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.33 1.052 . . . . 0.0 110.357 -175.275 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.11 157.12 66.37 Favored Pre-proline 0 N--CA 1.48 1.071 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 167.68 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.75 108.92 0.27 Allowed 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 122.323 2.015 . . . . 0.0 110.767 170.503 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.85 -22.99 67.08 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.07 0.948 . . . . 0.0 113.034 -168.245 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.1 m 62.08 33.53 17.02 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 122.585 1.184 . . . . 0.0 110.453 176.173 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.38 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.961 -178.138 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.528 ' HA2' ' HA ' ' B' ' 28' ' ' SER . . . . . . . . 0 N--CA 1.477 1.396 0 N-CA-C 111.943 -0.463 . . . . 0.0 111.943 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -95.79 -55.34 3.03 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.372 0.669 . . . . 0.0 110.322 -173.719 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -115.97 153.28 31.91 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 122.92 0.488 . . . . 0.0 110.538 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 47.9 t -133.85 128.24 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 167.785 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.569 ' HE2' HM32 ' B' ' 27' ' ' M3L . 63.6 m-85 -138.07 166.8 23.21 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.224 0.61 . . . . 0.0 109.84 175.142 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.92 151.38 44.76 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.42 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.446 HG12 HD11 ' A' ' 47' ' ' LEU . 2.5 p -138.49 133.41 42.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 C-N-CA 124.097 0.959 . . . . 0.0 109.479 -176.898 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.435 ' O ' ' HB3' ' B' ' 21' ' ' ALA . 10.7 tp10 -72.64 -50.5 24.77 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.91 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 p -174.25 175.36 2.68 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 124.336 1.054 . . . . 0.0 110.047 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.533 HD13 ' HB3' ' A' ' 22' ' ' TYR . 40.2 mm -78.67 116.9 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 168.226 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -64.61 -56.24 15.14 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 124.306 1.042 . . . . 0.0 109.179 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -141.26 165.94 26.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.11 0.964 . . . . 0.0 110.195 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -146.62 139.19 25.12 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.652 0.781 . . . . 0.0 109.71 -173.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -157.34 170.9 21.42 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.866 1.266 . . . . 0.0 108.49 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 t -129.16 132.88 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 118.665 0.666 . . . . 0.0 109.627 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.408 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 66.4 ttt180 -144.15 122.89 12.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.546 0.739 . . . . 0.0 109.231 -177.955 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.408 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 93.1 mttt 65.24 26.63 12.25 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.752 1.221 . . . . 0.0 111.76 176.746 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.85 -10.8 72.54 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.866 -176.916 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -98.79 115.12 28.08 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.844 0.858 . . . . 0.0 110.471 -176.008 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.4 112.09 14.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -92.23 143.44 26.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.187 0.995 . . . . 0.0 109.679 -175.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.533 ' HB3' HD13 ' A' ' 10' ' ' ILE . 66.8 m-85 -129.96 117.54 20.25 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.0 tp -68.63 89.09 0.36 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 172.243 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.553 HG21 HD12 ' A' ' 42' ' ' ILE . 97.4 t -74.65 107.89 5.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.627 0 C-N-CA 123.594 0.758 . . . . 0.0 110.526 -174.477 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -79.45 100.25 7.59 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.441 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.524 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 80.1 m95 -68.19 127.42 32.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.071 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -64.8 -41.18 96.01 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.985 0.914 . . . . 0.0 112.027 -166.136 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.43 18.81 52.97 Favored Glycine 0 N--CA 1.474 1.231 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.578 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.524 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 87.9 m95 -129.79 140.7 39.43 Favored Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 123.798 0.839 . . . . 0.0 109.861 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.422 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 80.1 Cg_exo -51.91 154.33 10.24 Favored 'Trans proline' 0 C--N 1.382 2.315 0 C-N-CA 123.544 2.829 . . . . 0.0 113.989 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -53.65 -24.19 28.75 Favored 'Trans proline' 0 C--N 1.386 2.514 0 C-N-CA 123.949 3.1 . . . . 0.0 114.841 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.422 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 58.6 pttt -66.42 -28.55 68.7 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 122.675 0.39 . . . . 0.0 111.471 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -88.94 2.38 53.95 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.352 0.661 . . . . 0.0 112.15 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.7 p -67.3 117.32 9.15 Favored 'General case' 0 C--N 1.356 0.883 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.495 HG23 HM11 ' B' ' 27' ' ' M3L . 20.3 p -108.22 136.42 47.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.859 0.864 . . . . 0.0 110.506 -173.907 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -69.89 80.62 0.46 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.413 0.685 . . . . 0.0 110.173 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.468 ' HB2' HD12 ' A' ' 42' ' ' ILE . 15.4 mm-40 -94.67 116.0 65.92 Favored Pre-proline 0 C--O 1.239 0.508 0 C-N-CA 123.63 0.772 . . . . 0.0 109.025 177.417 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -66.0 172.19 8.91 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 121.992 1.795 . . . . 0.0 112.19 172.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -54.13 -28.67 41.3 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.687 1.195 . . . . 0.0 112.355 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -59.66 -34.81 73.32 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.185 1.394 . . . . 0.0 111.709 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.717 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 11.4 m170 -85.05 -31.55 23.35 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.507 -173.763 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.553 HD12 HG21 ' A' ' 24' ' ' VAL . 36.9 mm -86.62 144.49 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 124.061 0.944 . . . . 0.0 111.666 -167.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.07 -72.14 0.38 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.543 0.737 . . . . 0.0 110.513 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.33 117.75 64.31 Favored Pre-proline 0 CA--C 1.557 1.227 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -78.3 -15.91 14.0 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.427 2.085 . . . . 0.0 112.893 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -72.76 -12.45 61.01 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 111.981 -173.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.446 HD11 HG12 ' A' ' 7' ' ' VAL . 3.1 mm? -50.95 -45.06 60.55 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 123.048 0.539 . . . . 0.0 110.885 168.163 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.4 t -61.24 -49.88 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.387 -176.88 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -68.83 -37.24 79.04 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.089 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.53 93.87 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.833 0.853 . . . . 0.0 111.017 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.474 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 18.8 t80 -61.92 -53.29 57.82 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.857 0.863 . . . . 0.0 110.667 174.716 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.8 -36.85 76.03 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.4 -170.674 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.1 -32.76 74.44 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 118.097 0.408 . . . . 0.0 111.296 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.451 ' HZ1' ' HB3' ' A' ' 54' ' ' LYS . 8.5 mtpm? -71.45 -26.16 62.6 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.685 0.794 . . . . 0.0 110.944 175.917 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -92.84 -17.0 24.63 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.808 0.843 . . . . 0.0 111.464 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 . . . . . 0 N--CA 1.48 1.058 0 C-N-CA 124.04 0.936 . . . . 0.0 108.579 176.879 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 90.9 mt -79.52 118.87 21.78 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.396 0.679 . . . . 0.0 109.53 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.435 ' HB3' ' O ' ' A' ' 8' ' ' GLU . . . -81.74 131.38 35.26 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.219 0.608 . . . . 0.0 111.467 -174.017 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 14.0 m -109.21 38.74 2.22 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 122.833 1.301 . . . . 0.0 108.176 172.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.3 mptm? -67.9 163.6 21.65 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-N 113.672 -1.604 . . . . 0.0 111.035 174.865 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.37 112.81 22.03 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.138 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.529 ' HB1' HD11 ' A' ' 42' ' ' ILE . . . -97.41 168.67 10.25 Favored 'General case' 0 C--O 1.245 0.841 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 169.655 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.438 ' NH2' ' HA3' ' A' ' 1' ' ' GLY . 17.7 ttt180 -150.54 149.3 29.76 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 122.92 0.488 . . . . 0.0 110.101 -169.525 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.569 HM32 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.243 0.732 0 C-N-CA 124.184 0.994 . . . . 0.0 109.205 176.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.717 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 31.5 m -83.45 79.03 9.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.995 0.426 . . . . 0.0 110.566 173.56 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.27 119.35 75.97 Favored Pre-proline 0 C--O 1.245 0.849 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.171 172.646 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -58.14 103.28 0.15 Allowed 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.245 1.964 . . . . 0.0 110.748 172.61 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.78 75.51 2.1 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 123.836 0.854 . . . . 0.0 111.222 -173.584 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 7.1 t -91.88 142.86 27.1 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.462 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.336 0 CA-C-O 118.808 -0.995 . . . . 0.0 111.824 -179.11 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.959 0 N-CA-C 112.652 -0.179 . . . . 0.0 112.652 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.435 ' HA ' ' O ' ' B' ' 27' ' ' M3L . 4.1 mp0 -101.78 91.03 4.21 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.778 0.831 . . . . 0.0 109.137 -177.647 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.499 ' HB2' ' HD2' ' B' ' 27' ' ' M3L . 1.8 mp0 -82.96 119.16 24.08 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.004 0.521 . . . . 0.0 110.772 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.8 t -103.05 127.71 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.348 1.059 . . . . 0.0 108.729 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.448 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 76.1 m-85 -138.87 158.04 44.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.368 0.667 . . . . 0.0 109.868 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.93 101.11 5.06 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 171.437 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -72.14 139.57 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.186 0.994 . . . . 0.0 110.996 -175.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.441 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 28.4 tt0 -73.11 -51.79 16.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.62 0.768 . . . . 0.0 109.907 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.9 p -175.07 -175.84 0.89 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.054 1.341 . . . . 0.0 109.403 175.628 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.515 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 42.9 mm -97.65 117.65 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 169.796 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.476 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.1 tmt_? -74.1 -58.07 3.54 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.5 1.12 . . . . 0.0 109.594 -177.72 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.476 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.3 mttm -136.72 178.83 6.77 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.8 0.84 . . . . 0.0 111.011 -176.182 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.422 ' HE3' HG13 ' A' ' 20' ' ' VAL . 86.1 tttt -158.42 147.57 19.17 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.51 1.124 . . . . 0.0 108.917 -175.557 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -164.03 143.81 8.03 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.995 0.918 . . . . 0.0 109.369 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.41 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 13.1 p -88.05 141.65 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.789 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.449 ' HA ' ' HE ' ' A' ' 16' ' ' ARG . 2.3 tpm_? -142.31 99.17 3.45 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.843 0.857 . . . . 0.0 108.747 -174.812 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 60.39 29.81 19.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.382 1.073 . . . . 0.0 111.487 -176.773 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.82 -17.35 58.85 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-N 116.264 -0.426 . . . . 0.0 113.417 -175.563 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.49 111.59 22.0 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.266 0.626 . . . . 0.0 110.067 177.889 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.422 HG13 ' HE3' ' A' ' 13' ' ' LYS . 50.6 t -85.44 111.39 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.006 -175.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.413 ' HB3' ' HB3' ' A' ' 36' ' ' TRP . 34.5 mm-40 -94.17 140.63 29.52 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.3 1.44 . . . . 0.0 109.411 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -120.12 120.55 36.55 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 43.7 tp -68.82 86.86 0.34 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 172.094 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.483 HG21 HD13 ' A' ' 42' ' ' ILE . 88.4 t -73.18 106.08 2.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.187 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -74.54 100.54 3.91 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.69 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.7 m95 -73.24 145.03 46.48 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.664 ' HZ3' ' HB2' ' A' ' 27' ' ' LYS . 3.8 ttmp? -71.24 -39.82 71.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 122.757 0.423 . . . . 0.0 111.836 -173.54 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.78 -10.97 74.94 Favored Glycine 0 C--N 1.346 1.112 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.403 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.596 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 23.3 m95 -110.24 141.67 24.37 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.496 0.718 . . . . 0.0 109.468 -176.916 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.73 163.65 36.72 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.414 2.076 . . . . 0.0 111.249 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.75 -26.28 72.58 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.045 2.497 . . . . 0.0 113.704 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.542 ' HB3' ' HZ1' ' A' ' 32' ' ' LYS . 0.3 OUTLIER -66.34 -38.71 88.27 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.253 0.621 . . . . 0.0 110.881 176.349 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.413 ' HB3' ' HE3' ' A' ' 29' ' ' TRP . 39.6 m-85 -99.05 0.45 43.75 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.463 0.705 . . . . 0.0 111.917 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.0 m -70.0 129.48 39.57 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.349 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.581 HG21 HM11 ' B' ' 27' ' ' M3L . 26.4 p -109.61 148.94 30.43 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.16 0.584 . . . . 0.0 111.833 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . 0.413 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 87.5 m95 -77.01 86.81 3.52 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.039 0.935 . . . . 0.0 110.402 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.481 ' HB2' HG21 ' A' ' 24' ' ' VAL . 38.8 mm-40 -97.9 118.44 63.89 Favored Pre-proline 0 C--O 1.241 0.647 0 C-N-CA 123.63 0.772 . . . . 0.0 109.305 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.414 ' O ' HG12 ' A' ' 42' ' ' ILE . 73.9 Cg_endo -73.65 177.46 7.99 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.176 1.917 . . . . 0.0 112.117 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.99 -27.2 51.79 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.745 1.218 . . . . 0.0 112.098 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.93 -28.72 69.73 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.918 1.287 . . . . 0.0 111.914 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.595 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 12.3 m170 -99.72 -28.76 13.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.045 0.938 . . . . 0.0 113.124 -172.803 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.483 HD13 HG21 ' A' ' 24' ' ' VAL . 43.8 mm -79.65 145.75 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 C-N-CA 123.948 0.899 . . . . 0.0 112.84 -169.884 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 mt -78.43 -64.34 1.19 Allowed 'General case' 0 C--N 1.358 0.974 0 C-N-CA 123.946 0.898 . . . . 0.0 110.852 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.93 117.46 65.12 Favored Pre-proline 0 N--CA 1.485 1.313 0 CA-C-O 119.412 -0.327 . . . . 0.0 110.628 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.99 -35.3 12.2 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.322 2.682 . . . . 0.0 112.6 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.0 mtm180 -70.45 -16.9 62.98 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.524 -174.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.5 tp -57.64 -44.03 85.33 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.537 1.135 . . . . 0.0 111.342 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.6 t -66.37 -41.94 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.543 0.737 . . . . 0.0 110.337 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.2 mtp -63.06 -30.49 71.64 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.397 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -37.01 85.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.678 0.791 . . . . 0.0 110.869 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.515 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.8 t80 -72.09 -35.04 69.11 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.973 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -64.03 -29.49 70.64 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.572 0.349 . . . . 0.0 110.589 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -70.37 -28.68 65.3 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.34 0.656 . . . . 0.0 111.679 173.747 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -62.15 -47.94 82.32 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.027 0.531 . . . . 0.0 110.958 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -91.76 101.81 14.42 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.28 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 . . . . . 0 CA--C 1.558 1.277 0 C-N-CA 124.246 1.018 . . . . 0.0 110.044 179.708 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 . . . . . 0 N--CA 1.494 1.727 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.57 104.06 4.4 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 123.941 0.896 . . . . 0.0 108.717 174.88 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.05 120.45 19.64 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 122.328 0.251 . . . . 0.0 110.339 177.694 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 24.2 p -84.49 -1.32 55.55 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.287 0.635 . . . . 0.0 110.434 168.513 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -57.05 153.8 10.85 Favored 'General case' 0 C--N 1.35 0.604 0 C-N-CA 124.786 1.234 . . . . 0.0 111.839 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.53 127.9 54.34 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.161 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -110.78 162.19 15.03 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 169.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 -142.62 159.86 41.43 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 123.09 0.556 . . . . 0.0 110.025 -172.824 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.581 HM11 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 124.426 1.09 . . . . 0.0 109.705 173.126 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.595 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 17.8 m -57.1 98.42 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 123.006 0.191 . . . . 0.0 110.554 175.272 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.27 115.43 26.08 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 123.16 0.584 . . . . 0.0 110.268 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -77.41 67.55 7.73 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 122.991 2.461 . . . . 0.0 111.207 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -132.8 139.91 47.74 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.384 1.074 . . . . 0.0 110.028 -172.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 35.9 p -79.44 85.98 5.17 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.346 0.658 . . . . 0.0 109.847 177.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.191 0 CA-C-O 119.022 -0.877 . . . . 0.0 112.376 -178.569 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.436 0 N-CA-C 112.33 -0.308 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -107.39 -80.94 0.56 Allowed 'General case' 0 C--N 1.351 0.665 0 C-N-CA 123.332 0.653 . . . . 0.0 110.297 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -152.17 157.51 41.61 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.562 0.745 . . . . 0.0 111.789 -168.932 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 69.1 t -128.31 129.36 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 125.378 1.471 . . . . 0.0 107.878 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.546 ' HE2' HM32 ' B' ' 27' ' ' M3L . 63.7 m-85 -141.7 162.59 35.11 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.367 0.667 . . . . 0.0 110.569 177.397 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.98 131.29 44.84 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.271 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.444 HG12 HD11 ' A' ' 47' ' ' LEU . 2.2 p -123.14 133.89 67.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 124.863 1.265 . . . . 0.0 108.55 -174.267 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -80.46 -40.39 26.32 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.706 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.3 p -175.91 179.46 1.33 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.788 0.835 . . . . 0.0 110.289 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.9 mm -89.73 122.78 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 165.483 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.525 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -80.89 -51.2 8.83 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.442 0.697 . . . . 0.0 109.371 -178.27 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 27.2 mtpp -137.11 171.77 14.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.621 0.768 . . . . 0.0 111.104 -175.975 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -155.24 143.25 20.04 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.538 0.735 . . . . 0.0 109.953 -174.016 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -160.91 144.43 13.25 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.701 0.8 . . . . 0.0 109.614 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.61 115.54 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -121.0 119.8 33.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.347 1.059 . . . . 0.0 109.41 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 63.51 25.65 14.52 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.175 0.99 . . . . 0.0 112.146 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.0 -12.78 52.43 Favored Glycine 0 N--CA 1.475 1.244 0 CA-C-N 116.227 -0.442 . . . . 0.0 113.053 -174.463 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.721 ' HB3' ' HZ2' ' A' ' 19' ' ' LYS . 1.3 mmmp? -83.67 111.64 19.32 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.494 1.118 . . . . 0.0 108.546 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 t -82.09 106.23 12.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -97.3 142.9 28.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.459 1.104 . . . . 0.0 109.61 -174.763 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 91.6 m-85 -127.25 126.22 42.32 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.601 0.76 . . . . 0.0 109.693 -176.691 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.455 HD22 ' HB3' ' A' ' 11' ' ' ARG . 50.0 tp -67.7 94.17 0.42 Allowed 'General case' 0 C--N 1.349 0.583 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.343 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.474 HG21 HD12 ' A' ' 42' ' ' ILE . 90.1 t -77.1 104.01 4.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.879 -178.326 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.525 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 26.6 tptp -79.97 99.99 7.89 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -177.269 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.6 m95 -67.05 136.43 55.22 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.981 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -58.7 -33.75 70.53 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.037 0.535 . . . . 0.0 111.024 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.54 -55.43 2.71 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.495 176.075 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 98.4 m95 -77.97 129.57 75.55 Favored Pre-proline 0 CA--C 1.563 1.443 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -170.567 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.49 160.13 1.78 Allowed 'Trans proline' 0 C--N 1.387 2.603 0 C-N-CA 124.673 3.582 . . . . 0.0 113.465 172.742 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.45 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 32.1 Cg_endo -60.55 -17.8 50.67 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 123.132 2.554 . . . . 0.0 114.415 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.7 pttt -83.13 -32.65 26.56 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.639 0.376 . . . . 0.0 111.214 174.172 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -87.22 -8.67 56.59 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.108 0.563 . . . . 0.0 110.578 173.994 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' SER . . . . . 0.41 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 68.0 m -73.44 133.25 43.65 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 171.503 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.8 p -99.44 133.36 43.87 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.558 0.743 . . . . 0.0 111.075 -168.759 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -75.02 83.54 2.26 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.263 0.625 . . . . 0.0 110.106 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.447 ' HB2' HG21 ' A' ' 24' ' ' VAL . 44.4 mm-40 -104.85 130.59 22.91 Favored Pre-proline 0 N--CA 1.468 0.444 0 C-N-CA 123.262 0.625 . . . . 0.0 110.448 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.403 ' O ' HG12 ' A' ' 42' ' ' ILE . 40.0 Cg_endo -64.54 164.46 23.55 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 122.003 1.802 . . . . 0.0 112.037 170.644 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -52.86 -30.51 34.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.46 1.104 . . . . 0.0 111.701 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.9 -34.59 78.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.212 1.405 . . . . 0.0 111.468 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.0 m170 -85.1 -9.94 57.37 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.961 0.904 . . . . 0.0 112.793 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.474 HD12 HG21 ' A' ' 24' ' ' VAL . 38.8 mm -90.48 155.94 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 123.943 0.897 . . . . 0.0 110.959 -176.596 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -84.13 -77.67 0.26 Allowed 'General case' 0 C--N 1.353 0.748 0 C-N-CA 123.128 0.571 . . . . 0.0 109.98 167.656 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -75.14 127.92 85.72 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-O 119.673 -0.203 . . . . 0.0 111.168 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.26 -31.34 22.96 Favored 'Trans proline' 0 C--N 1.375 1.937 0 C-N-CA 122.547 2.164 . . . . 0.0 113.802 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.2 -14.42 37.74 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.66 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.444 HD11 HG12 ' A' ' 7' ' ' VAL . 3.5 mm? -60.3 -50.59 73.03 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 118.749 0.704 . . . . 0.0 110.012 170.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.481 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 74.1 t -67.51 -54.01 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.882 178.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.418 ' SD ' ' N ' ' A' ' 49' ' ' MET . 0.4 OUTLIER -58.97 -45.48 90.43 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.746 0.819 . . . . 0.0 112.09 -173.369 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.12 87.3 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.281 0.363 . . . . 0.0 111.175 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.45 -37.34 86.6 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.061 0.945 . . . . 0.0 110.747 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.481 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 31.0 mm-40 -69.95 -23.13 63.14 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.282 0.633 . . . . 0.0 111.081 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -96.3 5.79 50.2 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.27 1.028 . . . . 0.0 112.227 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -78.47 165.55 23.64 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 120.87 0.367 . . . . 0.0 111.384 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.18 134.1 56.67 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.115 0.966 . . . . 0.0 112.178 -173.237 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 . . . . . 0 C--O 1.248 1.003 0 C-N-CA 123.964 0.906 . . . . 0.0 110.242 -179.598 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 121.042 0.448 . . . . 0.0 110.002 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 69.8 mt -92.55 159.95 15.26 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.354 1.061 . . . . 0.0 109.268 175.458 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.04 153.27 26.24 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.082 0.553 . . . . 0.0 110.398 177.427 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.7 p -121.86 5.05 9.94 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.472 0.709 . . . . 0.0 110.452 173.833 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -82.46 156.89 23.86 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 123.221 0.609 . . . . 0.0 110.756 -171.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -112.77 134.06 54.48 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.714 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.462 ' HB2' HD11 ' A' ' 42' ' ' ILE . . . -109.19 -175.69 2.83 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 171.566 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -150.67 155.69 39.86 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -170.36 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.546 HM32 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 N--CA 1.475 0.786 0 C-N-CA 123.689 0.795 . . . . 0.0 112.026 -175.674 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 34.9 p -167.88 157.88 10.3 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 122.053 -0.405 . . . . 0.0 111.416 -168.75 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.82 166.19 34.55 Favored Pre-proline 0 CA--C 1.558 1.268 0 C-N-CA 123.464 0.706 . . . . 0.0 110.863 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_exo -46.11 100.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.387 2.574 0 C-N-CA 123.244 2.629 . . . . 0.0 113.1 173.318 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.43 104.63 4.49 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.073 0.949 . . . . 0.0 111.548 -170.938 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.3 m -136.1 56.0 1.84 Allowed 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.616 -179.516 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.967 0 N-CA-C 111.826 -0.51 . . . . 0.0 111.826 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -68.24 93.0 0.43 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.271 0.628 . . . . 0.0 111.392 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -78.84 91.54 4.76 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.286 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -102.01 136.1 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.012 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -138.58 153.85 48.69 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.895 0.878 . . . . 0.0 109.014 170.823 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.66 134.38 47.49 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 173.734 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -120.63 141.78 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.211 1.005 . . . . 0.0 110.164 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -73.65 -60.27 2.33 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.579 174.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.419 ' HB3' HD21 ' B' ' 20' ' ' LEU . 30.3 p -170.91 -174.61 1.58 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.425 1.09 . . . . 0.0 109.548 -175.349 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.523 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 50.8 mm -97.87 117.86 43.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.018 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.24 -50.18 35.56 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.048 0.939 . . . . 0.0 110.529 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -140.72 170.8 15.09 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.475 0.71 . . . . 0.0 110.634 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -155.77 148.5 24.1 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.894 0.878 . . . . 0.0 108.635 -175.028 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.464 ' NH1' ' HD2' ' A' ' 16' ' ' ARG . 2.2 ptm180 -159.92 154.67 24.32 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.59 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -104.44 137.4 33.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 166.596 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.464 ' HD2' ' NH1' ' A' ' 14' ' ' ARG . 75.4 ttt180 -150.52 98.6 2.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -168.869 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 65.55 25.42 11.75 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.549 0.74 . . . . 0.0 111.115 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.71 -16.16 59.91 Favored Glycine 0 C--N 1.355 1.595 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.817 -173.892 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -84.24 111.32 19.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.9 t -86.95 108.04 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -97.05 144.43 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.126 0.57 . . . . 0.0 109.605 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.43 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.3 m-85 -123.45 116.82 23.86 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.7 tp -68.09 88.02 0.28 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 170.742 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.85 106.98 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.938 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -76.98 96.97 4.5 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.9 m95 -68.69 145.53 53.78 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -80.62 -30.35 36.75 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.6 -10.65 84.97 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 115.897 -0.592 . . . . 0.0 113.669 177.032 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.3 m95 -131.15 132.36 23.7 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 110.199 -177.208 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.411 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 32.4 Cg_endo -62.94 170.11 7.92 Favored 'Trans proline' 0 CA--C 1.572 2.395 0 C-N-CA 122.853 2.369 . . . . 0.0 112.483 175.168 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.62 -24.2 69.21 Favored 'Trans proline' 0 C--N 1.394 2.947 0 C-N-CA 122.793 2.328 . . . . 0.0 114.016 -174.89 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.86 -28.24 65.5 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.389 0.676 . . . . 0.0 112.512 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.525 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 80.2 m-85 -96.84 -3.59 41.83 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.17 0.588 . . . . 0.0 111.579 175.254 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.3 m -66.79 132.86 48.95 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.677 0.391 . . . . 0.0 109.988 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.472 HG22 HM13 ' B' ' 27' ' ' M3L . 30.1 p -122.79 150.37 42.9 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.651 -169.878 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -80.55 83.17 6.4 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.622 0.769 . . . . 0.0 110.521 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -95.17 121.22 62.75 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.57 165.39 29.45 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 121.853 1.702 . . . . 0.0 111.088 172.591 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -53.8 -27.25 28.12 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.078 0.951 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -60.3 -40.95 92.33 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.796 1.239 . . . . 0.0 110.992 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 17.3 m170 -81.45 -29.76 33.68 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.426 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.92 143.95 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.473 0.709 . . . . 0.0 111.348 -175.033 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.407 ' HB3' ' O ' ' B' ' 24' ' ' ALA . 5.1 tt -82.69 -77.53 0.23 Allowed 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.65 122.42 85.76 Favored Pre-proline 0 CA--C 1.556 1.186 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.496 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.33 -15.54 22.48 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 122.779 2.319 . . . . 0.0 114.107 -175.426 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 50.0 mtm180 -71.02 -12.14 61.36 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.25 -42.11 80.9 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 118.134 0.425 . . . . 0.0 111.127 170.194 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.498 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 48.0 t -62.12 -50.33 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.122 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.2 mmt -57.48 -40.16 77.97 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.129 0.972 . . . . 0.0 111.66 -177.986 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.531 ' HB1' HD23 ' B' ' 20' ' ' LEU . . . -65.17 -33.76 76.77 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.054 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.523 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 83.1 t80 -74.83 -37.67 62.23 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.429 0.692 . . . . 0.0 110.485 174.927 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.498 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 18.8 mm-40 -67.51 -20.49 65.45 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.792 0.437 . . . . 0.0 110.709 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 22.3 mm-40 -66.09 -19.52 65.87 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.699 0.799 . . . . 0.0 112.267 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.61 -19.73 63.63 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.872 0.469 . . . . 0.0 110.46 173.688 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -112.35 176.55 4.97 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.478 1.111 . . . . 0.0 109.542 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 . . . . . 0 C--O 1.251 1.178 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.81 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 . . . . . 0 N--CA 1.487 1.412 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . 0.531 HD23 ' HB1' ' A' ' 50' ' ' ALA . 5.0 mp -87.86 154.24 20.69 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.139 0.576 . . . . 0.0 109.989 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.31 112.25 2.99 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 173.539 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 11.2 m -69.53 96.32 0.91 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.554 0.692 . . . . 0.0 110.804 -173.007 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . 0.418 ' HZ2' ' HB3' ' B' ' 23' ' ' LYS . 1.7 mmmp? -90.29 -176.48 4.83 Favored 'General case' 0 C--O 1.246 0.896 0 CA-C-N 114.978 -1.01 . . . . 0.0 108.685 172.862 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . 0.407 ' O ' ' HB3' ' A' ' 43' ' ' LEU . . . -121.28 125.46 47.11 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -94.6 -179.25 4.82 Favored 'General case' 0 C--O 1.244 0.794 0 N-CA-C 107.921 -1.141 . . . . 0.0 107.921 169.113 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 -156.11 156.94 35.16 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -169.306 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.472 HM13 HG22 ' A' ' 35' ' ' THR . . . . . . . . 0 N--CA 1.475 0.778 0 C-N-CA 123.631 0.772 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 19.1 m -148.52 150.72 33.89 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.347 0.259 . . . . 0.0 111.466 -168.109 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.19 149.35 84.67 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.199 0.6 . . . . 0.0 110.784 176.449 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.44 -28.28 70.96 Favored 'Trans proline' 0 C--N 1.376 2.011 0 C-N-CA 122.426 2.084 . . . . 0.0 112.651 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . 78.17 -45.18 0.41 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.58 1.552 . . . . 0.0 114.379 170.143 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.3 m -65.12 -34.32 78.13 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.365 0.666 . . . . 0.0 111.466 -177.576 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.31 0 CA-C-O 118.667 -1.074 . . . . 0.0 111.565 178.999 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.084 0 N-CA-C 112.561 -0.216 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -84.99 92.28 8.29 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.623 0.769 . . . . 0.0 109.464 -179.391 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -73.53 83.79 1.52 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.079 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.8 t -124.99 122.51 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -133.3 160.97 35.76 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 123.31 0.644 . . . . 0.0 109.967 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.02 136.3 55.06 Favored 'General case' 0 C--O 1.248 1.017 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.045 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 p -116.34 145.27 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.82 0.848 . . . . 0.0 110.178 -174.358 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.605 ' HG3' HD11 ' B' ' 20' ' ' LEU . 45.8 tt0 -78.87 -56.17 4.6 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.803 0.841 . . . . 0.0 109.748 176.852 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.0 p -175.19 -171.53 0.52 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.491 1.116 . . . . 0.0 110.2 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.494 HD11 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -99.68 117.97 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 170.183 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -52.17 14.08 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.509 1.124 . . . . 0.0 110.221 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -139.72 169.41 17.78 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.418 0.687 . . . . 0.0 111.353 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -155.77 137.67 14.44 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.313 1.045 . . . . 0.0 108.781 -177.15 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -160.94 137.63 8.7 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.98 0.912 . . . . 0.0 108.935 177.883 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.46 129.85 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -136.61 113.76 10.64 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? 62.21 33.41 16.77 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 124.547 1.139 . . . . 0.0 109.459 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.84 -18.94 18.2 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.749 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -84.54 111.01 19.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.51 0.724 . . . . 0.0 109.303 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.9 t -78.59 110.77 14.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -93.98 138.76 31.73 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.61 1.164 . . . . 0.0 109.894 -171.329 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.494 ' HB3' HD11 ' A' ' 10' ' ' ILE . 79.1 m-85 -125.54 116.42 21.74 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.432 0.693 . . . . 0.0 109.434 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.8 tp -69.54 91.52 0.59 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 170.149 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.599 HG22 HD11 ' A' ' 42' ' ' ILE . 73.1 t -73.43 106.18 3.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.174 -175.789 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.527 ' HE2' ' HD3' ' A' ' 31' ' ' PRO . 25.4 tptp -76.2 102.4 5.78 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 174.274 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -73.21 154.68 40.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.087 0.555 . . . . 0.0 110.894 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -75.75 -44.28 42.54 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 171.159 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.48 -41.42 30.12 Favored Glycine 0 C--N 1.352 1.462 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.194 -178.168 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -100.91 143.19 26.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.231 0.612 . . . . 0.0 111.166 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.37 172.86 14.11 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 123.5 2.8 . . . . 0.0 112.415 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . 0.527 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 30.0 Cg_endo -61.21 -29.23 86.25 Favored 'Trans proline' 0 C--N 1.394 2.921 0 C-N-CA 122.963 2.442 . . . . 0.0 113.401 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -67.5 -30.05 69.63 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.296 0.638 . . . . 0.0 111.401 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 13.88 29.27 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.629 0.771 . . . . 0.0 111.614 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.9 m -74.43 136.03 42.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 169.637 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.8 p -114.84 138.16 51.1 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.492 0.717 . . . . 0.0 112.046 -168.44 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -74.88 87.76 2.29 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.542 0.737 . . . . 0.0 109.899 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.446 ' HB2' HD11 ' A' ' 42' ' ' ILE . 42.9 mm-40 -108.87 116.61 55.48 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 123.894 0.878 . . . . 0.0 109.905 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 38.4 Cg_endo -63.25 169.15 9.83 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 122.551 2.167 . . . . 0.0 112.699 169.795 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -34.81 48.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.306 1.442 . . . . 0.0 113.244 -178.454 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -67.72 -34.37 76.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.893 0.877 . . . . 0.0 110.867 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -78.78 -17.8 55.19 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.625 0.77 . . . . 0.0 111.455 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.599 HD11 HG22 ' A' ' 24' ' ' VAL . 48.9 mm -98.5 148.78 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 124.359 1.064 . . . . 0.0 110.749 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.7 mt -82.1 -70.62 0.53 Allowed 'General case' 0 C--N 1.352 0.675 0 C-N-CA 123.49 0.716 . . . . 0.0 109.919 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -77.01 132.74 70.36 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.902 -171.759 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.433 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 98.1 Cg_endo -78.48 -30.44 3.2 Favored 'Trans proline' 0 CA--C 1.562 1.913 0 C-N-CA 122.52 2.147 . . . . 0.0 115.0 -176.918 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.433 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.32 0.0 OUTLIER -72.61 -9.7 58.91 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.031 . . . . . . . . 4 4 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -53.18 -47.91 68.44 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 119.117 0.871 . . . . 0.0 109.911 166.371 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.421 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 63.0 t -60.87 -45.65 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.248 177.463 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.475 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 53.4 mtt -64.09 -30.1 71.19 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.649 0.78 . . . . 0.0 111.305 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.44 78.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 0.0 110.115 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.439 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 46.8 t80 -75.45 -35.12 60.96 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.743 174.389 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.421 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.7 mm-40 -69.76 -32.66 71.3 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.583 0.353 . . . . 0.0 111.063 -177.151 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.475 ' HG2' ' O ' ' A' ' 49' ' ' MET . 22.0 mm-40 -89.5 49.78 1.8 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.344 0.658 . . . . 0.0 111.179 -178.432 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.439 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 32.0 mmtp -95.88 124.39 39.88 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 122.998 0.519 . . . . 0.0 110.414 173.401 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -94.56 85.03 4.41 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 166.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 . . . . . 0 CA--C 1.559 1.291 0 C-N-CA 125.48 1.512 . . . . 0.0 110.114 -172.173 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.62 0.724 . . . . 0.0 109.962 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . 0.605 HD11 ' HG3' ' A' ' 8' ' ' GLU . 1.8 mm? -115.96 132.25 56.7 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 177.42 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.94 79.23 2.82 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 170.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 35.7 p -76.09 69.85 2.71 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.705 1.202 . . . . 0.0 111.055 -172.243 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -116.94 -172.87 2.29 Favored 'General case' 0 C--O 1.251 1.166 0 C-N-CA 124.18 0.992 . . . . 0.0 108.716 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -110.08 109.21 19.67 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.996 176.815 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.434 ' HB2' HD13 ' A' ' 42' ' ' ILE . . . -97.21 172.15 7.99 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 167.056 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.451 ' HD2' ' O ' ' B' ' 29' ' ' ALA . 18.7 ttp180 -159.77 152.62 21.59 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.516 -165.282 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.628 0 C-N-CA 123.763 0.825 . . . . 0.0 110.047 177.163 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 12.5 t 68.62 0.16 2.52 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 114.093 1.145 . . . . 0.0 114.093 169.271 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.451 ' O ' ' HD2' ' B' ' 26' ' ' ARG . . . -61.89 120.03 53.46 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 123.82 0.848 . . . . 0.0 111.877 -170.768 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.38 -23.39 70.04 Favored 'Trans proline' 0 C--N 1.38 2.227 0 C-N-CA 122.801 2.334 . . . . 0.0 112.401 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -105.76 173.65 6.22 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.031 0.933 . . . . 0.0 111.32 175.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.0 t -154.21 -16.9 0.13 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.629 0.771 . . . . 0.0 111.661 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.97 -0.906 . . . . 0.0 112.322 -175.457 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.509 ' HA ' ' O ' ' B' ' 27' ' ' M3L . 6.1 mp0 -103.59 68.57 0.94 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.47 0.708 . . . . 0.0 110.137 -173.158 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -108.46 142.69 38.47 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 120.988 0.423 . . . . 0.0 110.403 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.9 t -91.83 132.56 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.457 ' CE2' HM31 ' B' ' 27' ' ' M3L . 93.8 m-85 -131.93 163.0 29.31 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 171.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . 0.421 ' HB3' ' HE3' ' A' ' 27' ' ' LYS . . . -85.57 116.34 23.81 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.151 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.561 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -98.46 141.17 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.693 1.197 . . . . 0.0 109.28 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.49 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 9.7 tp10 -80.26 -49.53 11.47 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.468 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.0 p -171.38 171.79 5.41 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.142 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.54 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 49.5 mm -88.27 113.76 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.411 -0.813 . . . . 0.0 108.865 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.4 tmt_? -72.06 -53.07 13.98 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.546 0.738 . . . . 0.0 109.415 -178.442 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.6 mttm -137.82 173.89 11.16 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.316 0.646 . . . . 0.0 111.249 -176.717 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -157.5 150.38 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.974 0.91 . . . . 0.0 109.322 -174.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.9 ptt85 -168.23 178.75 4.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.622 1.169 . . . . 0.0 109.029 173.299 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.43 132.94 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.871 0.868 . . . . 0.0 108.747 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -142.64 111.76 6.52 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 59.91 42.61 16.02 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.575 1.15 . . . . 0.0 112.383 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.89 -17.32 32.24 Favored Glycine 0 N--CA 1.471 0.985 0 CA-C-N 115.8 -0.636 . . . . 0.0 113.516 176.63 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -84.73 109.91 18.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.1 t -83.92 104.13 11.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 171.006 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.523 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 1.0 OUTLIER -103.28 144.74 30.95 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.824 0.821 . . . . 0.0 110.9 -175.758 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -119.11 124.13 46.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.355 -173.235 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 55.1 tp -65.57 89.27 0.1 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 170.503 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.476 HG23 ' HB2' ' A' ' 37' ' ' GLU . 74.1 t -76.01 105.57 5.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.173 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -83.99 99.95 10.74 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 53.0 m95 -66.83 134.58 52.4 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.49 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -70.42 -15.96 62.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.479 0.312 . . . . 0.0 111.651 -177.694 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.09 10.11 22.74 Favored Glycine 0 C--N 1.351 1.373 0 CA-C-O 119.666 -0.519 . . . . 0.0 113.664 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 81.0 m95 -134.91 148.17 65.86 Favored Pre-proline 0 N--CA 1.498 1.965 0 CA-C-N 117.748 0.774 . . . . 0.0 110.158 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -74.53 165.27 32.05 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.911 2.407 . . . . 0.0 112.062 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.55 -33.87 49.87 Favored 'Trans proline' 0 C--N 1.391 2.775 0 C-N-CA 124.084 3.189 . . . . 0.0 114.646 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -69.43 -30.21 68.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.061 0.544 . . . . 0.0 112.357 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -95.05 -8.41 36.77 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.609 0.764 . . . . 0.0 111.441 175.083 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 59.4 m -75.35 112.23 11.44 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.732 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.484 HG23 HM23 ' B' ' 27' ' ' M3L . 20.4 p -98.36 147.79 24.33 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.64 0.776 . . . . 0.0 111.795 -169.601 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -75.12 89.02 2.46 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.441 0.696 . . . . 0.0 110.226 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.476 ' HB2' HG23 ' A' ' 24' ' ' VAL . 45.8 mm-40 -97.89 119.5 62.16 Favored Pre-proline 0 N--CA 1.469 0.507 0 C-N-CA 123.461 0.704 . . . . 0.0 109.872 178.287 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.523 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 47.4 Cg_endo -66.31 167.49 18.38 Favored 'Trans proline' 0 C--N 1.369 1.636 0 C-N-CA 122.07 1.846 . . . . 0.0 112.001 172.605 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.07 -27.0 61.33 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.416 1.087 . . . . 0.0 112.262 176.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.42 -35.33 65.28 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 125.176 1.39 . . . . 0.0 111.717 171.907 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.695 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 16.6 m170 -93.44 -18.15 22.66 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.075 0.95 . . . . 0.0 112.559 -173.92 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.426 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.1 mm -86.54 151.57 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.061 0.944 . . . . 0.0 111.352 -171.793 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -96.73 -69.15 0.77 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.749 0.82 . . . . 0.0 110.823 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.15 117.34 53.38 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.404 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 72.0 Cg_endo -74.37 -17.83 20.93 Favored 'Trans proline' 0 C--N 1.369 1.646 0 C-N-CA 122.722 2.281 . . . . 0.0 113.185 -175.939 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.404 ' HD3' ' HG2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -72.22 -12.22 61.07 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.502 0.721 . . . . 0.0 112.481 -177.652 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.2 mm? -52.13 -51.06 60.22 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 118.512 0.597 . . . . 0.0 110.59 169.479 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 59.3 t -61.04 -48.4 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 124.107 0.879 . . . . 0.0 109.694 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.2 mmt -60.44 -38.49 84.31 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.998 -175.118 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.84 -36.41 83.39 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.754 0.821 . . . . 0.0 110.571 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.54 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 81.5 t80 -69.8 -42.72 73.36 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.723 0.809 . . . . 0.0 110.424 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.3 mm-40 -60.69 -37.88 83.14 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.263 0.625 . . . . 0.0 111.285 -177.288 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -65.96 -38.76 89.42 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.884 0.873 . . . . 0.0 112.218 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -92.29 128.28 38.08 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.273 0.558 . . . . 0.0 110.724 -176.17 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -143.79 92.0 2.3 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 . . . . . 0 CA--C 1.555 1.144 0 C-N-CA 123.62 0.768 . . . . 0.0 110.946 -171.572 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 93.4 mt -75.92 105.28 6.87 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.905 0.482 . . . . 0.0 109.707 179.026 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -99.15 33.07 2.49 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.269 1.028 . . . . 0.0 109.83 178.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 22' ' ' THR . . . . . 0.416 ' HA ' ' O ' ' A' ' 7' ' ' VAL . 34.3 m -61.6 106.92 0.72 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.906 0.882 . . . . 0.0 111.04 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -126.79 -173.19 2.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.518 1.527 . . . . 0.0 109.492 -175.001 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -107.06 106.64 17.25 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.097 0.475 . . . . 0.0 110.761 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -106.75 151.05 25.66 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 162.254 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -134.52 158.95 42.65 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -175.098 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.509 ' O ' ' HA ' ' A' ' 2' ' ' GLU . . . . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 171.932 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.695 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 15.2 m -67.74 77.04 0.2 Allowed 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 121.125 0.488 . . . . 0.0 109.983 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.68 123.05 88.24 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -175.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.18 150.96 45.81 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.093 2.529 . . . . 0.0 112.825 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.77 -34.09 75.25 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.775 0.83 . . . . 0.0 110.789 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 14.1 t -157.85 166.39 32.8 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.535 1.134 . . . . 0.0 109.381 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.122 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 -176.83 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.416 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.431 ' HA ' ' O ' ' B' ' 27' ' ' M3L . 39.6 mt-10 -78.5 102.87 8.08 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.474 0.709 . . . . 0.0 109.664 176.52 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.61 ' HB2' ' HD2' ' B' ' 27' ' ' M3L . 15.0 mm100 -92.87 110.93 22.4 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.241 0.616 . . . . 0.0 110.846 -174.689 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 91.4 t -103.24 116.19 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.565 0.746 . . . . 0.0 109.108 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -130.34 167.03 19.18 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 123.718 0.807 . . . . 0.0 109.402 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.13 122.06 19.44 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.035 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.2 p -97.97 135.94 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.356 0.662 . . . . 0.0 110.177 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -68.19 -52.72 31.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.951 0.901 . . . . 0.0 110.007 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.2 p -177.72 178.0 1.05 Allowed 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.714 -176.831 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.457 HD12 ' HB3' ' A' ' 22' ' ' TYR . 47.9 mm -89.95 114.99 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 168.956 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.549 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -69.82 -51.4 33.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.643 0.777 . . . . 0.0 109.05 -179.393 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -139.26 161.82 36.49 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.301 0.641 . . . . 0.0 111.348 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . 0.507 ' HE3' HG11 ' A' ' 20' ' ' VAL . 83.1 tttt -147.69 133.35 18.85 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 108.064 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -159.29 139.39 11.97 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 123.476 0.71 . . . . 0.0 109.396 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.471 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 5.0 p -87.22 121.41 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -134.46 123.49 24.07 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.74 0.816 . . . . 0.0 109.045 -176.558 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 64.24 28.02 13.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.324 1.05 . . . . 0.0 111.854 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.83 -16.97 53.31 Favored Glycine 0 C--N 1.351 1.406 0 CA-C-N 115.484 -0.78 . . . . 0.0 113.258 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -105.46 134.3 48.8 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.82 0.848 . . . . 0.0 110.443 -176.631 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.507 HG11 ' HE3' ' A' ' 13' ' ' LYS . 21.7 t -83.2 116.36 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -174.527 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -95.36 142.03 28.23 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 124.895 1.278 . . . . 0.0 109.741 -178.066 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.457 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.1 m-85 -125.0 120.44 31.56 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.49 0.716 . . . . 0.0 109.75 -178.706 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.502 HD23 ' HD2' ' A' ' 11' ' ' ARG . 27.7 tp -75.22 82.32 2.37 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 169.787 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.432 HG22 HD13 ' A' ' 42' ' ' ILE . 67.1 t -68.65 106.49 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.421 -175.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.549 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.3 tptp -84.53 102.82 13.15 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.552 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.58 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.8 m95 -71.5 147.05 48.14 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.247 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -78.44 -36.14 45.87 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.157 0.583 . . . . 0.0 109.903 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.43 -14.45 82.16 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.775 178.595 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.58 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.4 m95 -120.3 148.92 48.51 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 123.253 0.621 . . . . 0.0 111.381 -175.65 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 169.97 20.62 Favored 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.22 2.613 . . . . 0.0 112.2 175.104 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -55.52 -26.43 54.45 Favored 'Trans proline' 0 C--N 1.393 2.893 0 C-N-CA 123.715 2.943 . . . . 0.0 114.999 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -70.41 -9.23 55.8 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.408 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 69.5 m-85 -118.02 14.25 14.06 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.869 0.867 . . . . 0.0 111.409 175.398 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -70.07 116.8 10.86 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.0 p -105.36 137.19 43.56 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.297 0.639 . . . . 0.0 111.878 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -73.87 83.43 1.68 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.111 0.564 . . . . 0.0 109.933 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -110.62 113.14 55.96 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 123.892 0.877 . . . . 0.0 108.863 176.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.9 Cg_endo -66.8 166.84 21.1 Favored 'Trans proline' 0 C--N 1.365 1.424 0 C-N-CA 122.238 1.959 . . . . 0.0 111.782 173.833 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.21 -23.87 50.75 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.582 1.153 . . . . 0.0 112.807 -177.827 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -62.46 -27.25 68.99 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.106 1.362 . . . . 0.0 111.655 178.246 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -113.01 2.84 15.9 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.398 1.079 . . . . 0.0 112.408 -173.243 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.539 HD12 ' HB3' ' B' ' 25' ' ' ALA . 48.8 mm -101.16 148.55 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 124.58 1.152 . . . . 0.0 110.793 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.612 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 53.5 mt -75.68 -78.93 0.1 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 122.989 0.515 . . . . 0.0 110.811 172.458 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -75.05 112.85 19.92 Favored Pre-proline 0 N--CA 1.48 1.07 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -174.0 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -78.21 -13.65 15.29 Favored 'Trans proline' 0 C--N 1.371 1.752 0 C-N-CA 122.872 2.382 . . . . 0.0 112.945 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.56 -12.38 61.34 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.469 0.708 . . . . 0.0 111.41 179.111 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.606 HD22 ' HZ1' ' B' ' 23' ' ' LYS . 3.1 mm? -51.05 -39.16 55.31 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.478 0.311 . . . . 0.0 110.87 167.521 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.5 -51.48 46.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 123.861 0.864 . . . . 0.0 110.882 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.438 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 28.3 ptm -64.08 -35.08 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.0 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.11 -34.03 76.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.672 0.789 . . . . 0.0 111.315 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.445 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 74.3 t80 -70.14 -35.36 74.01 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.458 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -85.14 -7.44 59.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.5 0.72 . . . . 0.0 111.965 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.438 ' HG2' ' O ' ' A' ' 49' ' ' MET . 43.8 mm-40 -72.63 -13.59 61.41 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.71 0.404 . . . . 0.0 109.978 166.67 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.1 165.66 15.6 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 122.991 0.516 . . . . 0.0 109.802 174.214 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -88.48 116.19 26.53 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.868 0.867 . . . . 0.0 111.286 -172.619 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 C--O 1.252 1.227 0 C-N-CA 123.664 0.785 . . . . 0.0 109.755 175.64 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 55.7 tp -136.49 122.29 19.91 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.783 0.833 . . . . 0.0 108.942 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.76 107.13 17.48 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.159 0.584 . . . . 0.0 110.568 -177.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.1 p -91.07 43.04 1.13 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 122.634 1.207 . . . . 0.0 108.629 168.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . 0.606 ' HZ1' HD22 ' A' ' 47' ' ' LEU . 6.8 mtpm? -123.57 146.69 47.95 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 126.503 1.921 . . . . 0.0 107.321 -168.407 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -117.96 137.93 52.51 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.107 0.479 . . . . 0.0 111.041 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.539 ' HB3' HD12 ' A' ' 42' ' ' ILE . . . -102.9 -167.65 1.42 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.41 171.975 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.612 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 75.9 ttt180 -156.39 143.61 19.02 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -172.582 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.61 ' HD2' ' HB2' ' A' ' 3' ' ' GLN . . . . . . . . 0 C--O 1.242 0.678 0 C-N-CA 123.287 0.635 . . . . 0.0 109.742 173.312 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.423 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 17.2 m -69.82 139.26 53.14 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 170.469 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.17 154.49 30.48 Favored Pre-proline 0 N--CA 1.479 0.986 0 C-N-CA 122.95 0.5 . . . . 0.0 111.107 177.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 73.0 Cg_exo -52.54 -26.8 30.12 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 122.963 2.442 . . . . 0.0 114.187 177.932 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.01 29.2 7.29 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.073 0.949 . . . . 0.0 111.051 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 21.0 m -145.1 136.92 25.57 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.517 0.727 . . . . 0.0 109.737 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.186 0 CA-C-O 118.936 -0.924 . . . . 0.0 112.332 176.537 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.546 0 N-CA-C 111.858 -0.497 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.702 ' HG2' ' H ' ' B' ' 29' ' ' ALA . 37.9 mt-10 -78.76 88.86 4.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.557 0.743 . . . . 0.0 110.349 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -99.39 111.16 23.57 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.334 1.054 . . . . 0.0 110.778 -171.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 20.0 t -88.3 127.19 41.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.464 0.706 . . . . 0.0 109.635 179.992 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.416 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 87.7 m-85 -140.58 152.76 45.74 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.291 0.636 . . . . 0.0 110.113 172.659 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.28 117.37 11.75 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 170.074 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -91.39 134.19 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 110.104 -177.625 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.536 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 43.8 tt0 -68.04 -43.68 78.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.424 0.69 . . . . 0.0 110.505 178.232 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 p 177.94 169.51 0.72 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.386 1.074 . . . . 0.0 110.399 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.472 HG22 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -82.19 113.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.267 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.489 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -73.02 -58.12 3.54 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -177.378 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 98.3 mttt -134.31 174.29 10.68 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.723 0.809 . . . . 0.0 109.789 -178.547 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -159.85 141.59 12.95 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 123.756 0.822 . . . . 0.0 109.075 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -154.12 159.46 41.48 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.521 0.728 . . . . 0.0 109.755 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.404 HG23 HG21 ' A' ' 20' ' ' VAL . 40.8 t -104.13 130.25 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 168.779 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -146.73 111.53 5.31 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.3 tptt 65.43 26.35 11.91 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.809 1.243 . . . . 0.0 110.324 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.83 -9.21 46.0 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-N 115.228 -0.896 . . . . 0.0 113.156 -174.279 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.06 110.55 20.71 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.404 HG21 HG23 ' A' ' 15' ' ' VAL . 47.9 t -84.1 107.07 15.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -174.437 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -98.49 141.42 31.37 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.784 0.834 . . . . 0.0 110.477 -173.022 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.472 ' HB3' HG22 ' A' ' 10' ' ' ILE . 8.6 m-85 -114.23 125.01 53.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 31.9 tp -70.86 85.17 0.67 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 169.669 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.425 HG23 ' HB2' ' A' ' 37' ' ' GLU . 95.3 t -72.78 104.13 1.92 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.454 -173.215 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.489 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.8 tptp -84.0 100.34 11.0 Favored 'General case' 0 C--N 1.345 0.388 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.1 m95 -69.35 151.03 46.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.623 -179.717 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.536 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 35.7 ttpt -67.88 -46.11 72.6 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 122.981 0.512 . . . . 0.0 111.419 -173.795 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.87 -6.15 72.81 Favored Glycine 0 C--N 1.35 1.34 0 CA-C-N 115.878 -0.601 . . . . 0.0 113.868 -176.877 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.556 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 56.3 m95 -114.85 129.49 24.97 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.404 0.682 . . . . 0.0 110.148 -175.124 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -61.57 165.35 13.64 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.155 2.57 . . . . 0.0 112.35 171.925 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -64.41 -8.95 18.38 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.378 2.718 . . . . 0.0 114.709 -175.506 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.614 ' HZ2' ' HB2' ' A' ' 32' ' ' LYS . 0.0 OUTLIER -73.58 -26.84 61.0 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.464 0.306 . . . . 0.0 110.998 173.531 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -99.45 -12.41 20.24 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.813 0.845 . . . . 0.0 111.52 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.7 p -64.65 119.8 11.21 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.7 p -107.06 150.27 26.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.787 0.835 . . . . 0.0 111.113 -172.333 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -76.41 86.63 3.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.46 0.704 . . . . 0.0 110.194 178.017 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.425 ' HB2' HG23 ' A' ' 24' ' ' VAL . 47.2 mm-40 -98.17 110.19 55.1 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 123.607 0.763 . . . . 0.0 109.356 175.539 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.464 ' O ' HG12 ' A' ' 42' ' ' ILE . 61.7 Cg_endo -68.99 176.43 6.2 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.257 1.972 . . . . 0.0 112.114 172.646 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -60.08 -23.22 63.61 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.501 0.72 . . . . 0.0 112.354 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -58.45 -38.85 78.35 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 124.223 1.009 . . . . 0.0 110.975 172.077 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.743 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 42.6 m170 -94.18 -15.7 24.36 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.346 1.058 . . . . 0.0 112.457 -173.734 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.464 HG12 ' O ' ' A' ' 38' ' ' PRO . 46.6 mm -83.69 147.15 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 123.567 0.747 . . . . 0.0 112.121 -173.439 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -88.2 -70.47 0.63 Allowed 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.827 0.851 . . . . 0.0 109.896 172.96 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -77.42 115.97 53.88 Favored Pre-proline 0 CA--C 1.55 0.956 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 -176.094 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.3 -18.95 20.18 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.713 2.275 . . . . 0.0 112.955 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.459 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 75.2 mtm180 -73.99 -15.04 61.11 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.718 0.807 . . . . 0.0 111.974 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.9 mt -53.43 -52.55 59.04 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.029 0.932 . . . . 0.0 112.13 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.66 -34.97 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.238 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.459 ' SD ' ' HA ' ' A' ' 46' ' ' ARG . 57.5 mtt -59.97 -43.27 95.2 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.49 0.716 . . . . 0.0 111.017 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.62 78.48 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.389 0.676 . . . . 0.0 111.412 176.783 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -73.93 -32.94 63.75 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -75.38 -20.49 58.94 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.585 0.754 . . . . 0.0 112.118 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -68.6 -21.19 64.52 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.081 0.552 . . . . 0.0 111.267 173.216 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -123.51 -174.68 3.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.332 1.053 . . . . 0.0 109.48 175.263 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 59.84 15.17 4.67 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.978 1.311 . . . . 0.0 112.964 174.305 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 . . . . . 0 CA--C 1.558 1.256 0 C-N-CA 124.098 0.959 . . . . 0.0 110.381 -176.012 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 121.321 0.581 . . . . 0.0 109.96 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 5.3 mp -95.39 140.01 30.88 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.63 134.54 44.61 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.486 0.715 . . . . 0.0 110.37 -173.651 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 81.6 p -89.78 3.27 53.36 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.274 1.03 . . . . 0.0 110.128 171.088 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -82.05 144.24 30.97 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 125.536 1.534 . . . . 0.0 109.886 -175.58 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -96.03 137.96 34.35 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.063 0.545 . . . . 0.0 110.557 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.99 167.52 12.08 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 169.884 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.417 ' HD2' ' HB3' ' A' ' 2' ' ' GLU . 60.1 ttp180 -144.45 160.73 40.59 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.355 0.598 . . . . 0.0 109.565 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.45 ' O ' ' HA ' ' A' ' 2' ' ' GLU . . . . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 115.219 -0.9 . . . . 0.0 108.714 167.668 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.743 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 15.9 m -62.41 96.05 0.07 Allowed 'General case' 0 C--N 1.363 1.18 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.379 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.702 ' H ' ' HG2' ' A' ' 2' ' ' GLU . . . -61.57 123.79 78.29 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.483 1.113 . . . . 0.0 111.412 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_exo -65.77 166.73 19.33 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 123.152 2.568 . . . . 0.0 112.884 179.4 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.06 147.19 29.26 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 123.382 0.673 . . . . 0.0 109.414 173.246 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t -161.71 171.67 17.51 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 122.934 0.494 . . . . 0.0 110.715 -176.1 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.165 0 CA-C-O 118.826 -0.986 . . . . 0.0 110.768 175.869 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.633 0 N-CA-C 111.949 -0.461 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.543 ' HA ' ' HB1' ' B' ' 29' ' ' ALA . 8.5 pt-20 -89.17 167.89 12.74 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.346 0.658 . . . . 0.0 110.83 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -137.11 100.68 4.34 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 122.902 0.481 . . . . 0.0 109.868 177.747 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.38 134.24 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.342 1.057 . . . . 0.0 109.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.651 ' HE2' HM11 ' B' ' 27' ' ' M3L . 61.8 m-85 -132.52 159.02 40.62 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 123.227 0.611 . . . . 0.0 109.633 172.365 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.03 124.97 24.54 Favored 'General case' 0 C--O 1.249 1.064 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 170.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.453 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 6.3 p -113.59 145.86 18.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 C-N-CA 124.019 0.927 . . . . 0.0 110.349 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -78.67 -61.59 1.96 Allowed 'General case' 0 C--O 1.245 0.828 0 C-N-CA 124.042 0.937 . . . . 0.0 109.935 179.123 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.7 p -167.47 -172.09 1.85 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.041 0.936 . . . . 0.0 110.024 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.4 mm -102.2 133.6 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.14 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.451 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -85.62 -58.67 2.57 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.359 1.063 . . . . 0.0 109.19 -177.986 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.451 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.6 mttm -132.54 179.68 5.99 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.788 0.835 . . . . 0.0 110.264 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -156.24 154.63 31.03 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -169.977 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -164.41 170.54 15.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.421 1.088 . . . . 0.0 109.454 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.72 112.94 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 171.724 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -129.9 112.7 13.8 Favored 'General case' 0 C--O 1.24 0.585 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -174.013 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 80.6 tttt 63.77 33.92 12.45 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.021 1.328 . . . . 0.0 110.199 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.32 -14.85 43.16 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.236 -0.893 . . . . 0.0 113.744 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.595 ' HB2' ' HZ3' ' A' ' 19' ' ' LYS . 9.7 mtmp? -84.2 112.38 20.21 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.412 0.685 . . . . 0.0 109.643 -179.606 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.12 106.52 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.402 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 49.1 mt-10 -103.77 137.16 42.18 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.959 0.904 . . . . 0.0 110.755 -170.642 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -119.0 126.83 52.64 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 124.326 1.05 . . . . 0.0 109.224 -171.73 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.41 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 33.4 tp -74.47 84.67 2.01 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.268 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.417 HG23 ' HB2' ' A' ' 37' ' ' GLU . 68.4 t -64.71 108.24 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 124.625 1.17 . . . . 0.0 111.174 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.419 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.6 tptp -94.64 102.23 14.12 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.241 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.571 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 21.1 m95 -74.72 152.58 39.09 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.663 0.785 . . . . 0.0 110.162 -178.0 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -80.7 -29.24 36.48 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 122.218 0.207 . . . . 0.0 111.262 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.36 -3.87 62.89 Favored Glycine 0 C--N 1.346 1.115 0 O-C-N 123.479 0.487 . . . . 0.0 113.023 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.571 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 62.0 m95 -124.23 127.86 25.2 Favored Pre-proline 0 CA--C 1.553 1.072 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -60.44 163.78 14.42 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 123.066 2.511 . . . . 0.0 112.234 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -61.93 -10.15 16.61 Favored 'Trans proline' 0 C--N 1.386 2.545 0 C-N-CA 123.007 2.471 . . . . 0.0 114.843 -174.419 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.544 ' HB3' ' HZ2' ' A' ' 32' ' ' LYS . 0.4 OUTLIER -66.84 -31.29 71.81 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.815 0.279 . . . . 0.0 110.902 172.159 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.414 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 60.6 m-85 -98.51 10.82 40.06 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 112.122 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.2 p -68.69 125.06 25.38 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.514 HG21 HM33 ' B' ' 27' ' ' M3L . 22.5 p -112.95 129.97 56.29 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.631 0.772 . . . . 0.0 111.588 -169.313 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -68.94 82.26 0.31 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.651 0.78 . . . . 0.0 110.708 175.845 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB2' HG23 ' A' ' 24' ' ' VAL . 21.5 mm-40 -107.9 115.68 58.39 Favored Pre-proline 0 C--O 1.243 0.749 0 C-N-CA 123.774 0.829 . . . . 0.0 109.149 177.583 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.455 ' O ' HG12 ' A' ' 42' ' ' ILE . 41.9 Cg_endo -63.68 168.91 10.84 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.481 2.121 . . . . 0.0 112.048 170.346 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.5 -19.34 63.49 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.17 -37.79 78.2 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.864 0.865 . . . . 0.0 111.129 169.122 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -87.37 -18.18 30.65 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 112.342 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.487 HD12 ' HB3' ' B' ' 25' ' ' ALA . 42.0 mm -93.74 146.15 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 124.277 0.986 . . . . 0.0 111.657 -172.019 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.455 HD12 ' HE ' ' B' ' 26' ' ' ARG . 95.6 mt -87.91 -65.51 1.01 Allowed 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.577 0.751 . . . . 0.0 110.87 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -72.12 124.27 90.62 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 122.921 0.489 . . . . 0.0 110.143 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.57 -17.88 20.36 Favored 'Trans proline' 0 C--N 1.374 1.879 0 C-N-CA 122.734 2.289 . . . . 0.0 112.995 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.522 ' HA ' ' HB3' ' A' ' 49' ' ' MET . 54.4 mtm180 -73.66 -11.44 60.41 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.784 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.77 -53.7 48.62 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.217 0.917 . . . . 0.0 110.925 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.514 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.7 p -69.3 -44.0 80.78 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.156 176.726 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.522 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 23.2 ttt -57.05 -41.95 79.63 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.395 0.678 . . . . 0.0 111.92 -177.213 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.14 73.86 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.936 0.894 . . . . 0.0 110.436 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.522 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 67.7 t80 -75.17 -28.14 59.96 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.67 176.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.514 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 23.8 mm-40 -81.82 -6.86 59.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.773 0.429 . . . . 0.0 111.822 177.118 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -68.48 -18.49 64.41 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.898 0.479 . . . . 0.0 111.513 175.861 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 20.9 ptmt -91.94 -1.47 57.26 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.838 0.455 . . . . 0.0 111.859 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -71.41 150.81 44.63 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.162 0.585 . . . . 0.0 111.478 -178.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 . . . . . 0 CA--C 1.55 0.98 0 C-N-CA 123.749 0.819 . . . . 0.0 109.494 -179.669 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 . . . . . 0 N--CA 1.483 1.208 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 53.8 tp 67.57 98.16 0.05 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.032 1.333 . . . . 0.0 111.146 176.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -155.49 120.24 4.75 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 175.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 6.2 t -73.76 120.53 19.48 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 121.37 0.605 . . . . 0.0 109.641 176.989 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -117.13 175.43 5.6 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.28 1.032 . . . . 0.0 110.079 -172.75 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -138.75 111.26 7.55 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.378 0.671 . . . . 0.0 109.502 176.097 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.487 ' HB3' HD12 ' A' ' 42' ' ' ILE . . . -99.37 167.53 10.58 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.868 174.515 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.539 ' HD3' ' HB2' ' B' ' 29' ' ' ALA . 15.2 ttm180 -134.7 152.21 51.59 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 123.255 0.622 . . . . 0.0 109.531 -176.704 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.651 HM11 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.239 0.544 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 172.835 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 32.4 t 72.59 -89.24 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.023 0.929 . . . . 0.0 110.42 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . 0.543 ' HB1' ' HA ' ' A' ' 2' ' ' GLU . . . 38.11 104.09 0.01 OUTLIER Pre-proline 0 C--N 1.373 1.614 0 C-N-CA 126.542 1.937 . . . . 0.0 115.373 170.376 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 14.9 Cg_endo -53.15 102.68 0.08 OUTLIER 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 123.013 2.475 . . . . 0.0 111.938 -177.805 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.57 163.01 28.59 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.772 0.829 . . . . 0.0 111.612 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 33.1 p -64.32 93.9 0.1 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.168 0.987 . . . . 0.0 111.692 -174.346 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.263 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.936 176.179 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 111.222 -0.751 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.24 108.92 2.05 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.544 0.738 . . . . 0.0 110.157 176.416 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -133.07 152.04 51.99 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.471 0.653 . . . . 0.0 111.27 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.7 t -117.42 131.99 68.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.797 1.639 . . . . 0.0 107.871 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.417 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 69.1 m-85 -132.66 164.45 26.69 Favored 'General case' 0 C--O 1.248 0.98 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 173.413 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 104.93 1.54 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 168.184 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.499 HG13 HD11 ' A' ' 47' ' ' LEU . 2.9 p -89.57 138.57 19.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.711 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.08 -178.302 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.604 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 38.2 tt0 -71.81 -62.56 1.37 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.231 1.012 . . . . 0.0 109.561 176.52 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.414 ' HA ' HD13 ' A' ' 47' ' ' LEU . 27.7 p -173.6 -172.57 0.78 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.512 1.125 . . . . 0.0 109.216 -177.219 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.4 mm -94.78 133.16 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 169.241 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -99.2 -37.06 9.45 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.186 0.594 . . . . 0.0 110.558 -174.489 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 65.9 mttm -143.69 169.96 16.76 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.992 0.917 . . . . 0.0 109.921 176.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -152.48 149.29 28.39 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -174.806 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -163.71 -175.47 4.15 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.414 1.085 . . . . 0.0 109.487 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -144.02 141.63 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 173.445 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -137.9 107.89 6.35 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.616 0.767 . . . . 0.0 109.045 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.4 mttt 61.75 36.5 16.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.869 0.868 . . . . 0.0 111.482 173.559 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.62 -13.82 66.46 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.57 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HB3' ' HZ1' ' A' ' 19' ' ' LYS . 1.1 mmmp? -88.12 107.45 18.77 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.32 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.9 t -83.53 108.49 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -96.52 138.75 33.64 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.465 0.706 . . . . 0.0 110.197 -169.928 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 71.1 m-85 -122.66 121.94 37.61 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.898 0.879 . . . . 0.0 108.633 178.575 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 26.1 tp -71.68 86.64 0.93 Allowed 'General case' 0 C--O 1.24 0.583 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 174.424 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 78.4 t -70.85 104.82 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.494 -176.237 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -81.37 100.24 9.13 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.417 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 21.7 m95 -76.14 124.43 27.41 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 172.497 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.604 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -72.37 113.93 9.94 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.658 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 118.07 -14.65 12.4 Favored Glycine 0 C--N 1.346 1.139 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.215 -172.494 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.407 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 59.8 m95 -110.07 135.19 20.54 Favored Pre-proline 0 N--CA 1.475 0.799 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.818 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.29 155.24 30.68 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.746 2.297 . . . . 0.0 112.869 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.43 -13.44 10.29 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 123.52 2.813 . . . . 0.0 114.298 176.531 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -82.75 -46.47 13.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.693 0.397 . . . . 0.0 110.196 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -79.68 -1.36 37.99 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.252 0.621 . . . . 0.0 112.206 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.6 p -64.68 132.14 48.87 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 165.951 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.67 HG21 HM33 ' B' ' 27' ' ' M3L . 38.1 p -109.75 138.21 46.44 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.039 0.536 . . . . 0.0 111.98 -166.428 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -74.29 87.31 1.98 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.41 0.684 . . . . 0.0 110.107 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -103.74 125.1 35.63 Favored Pre-proline 0 N--CA 1.468 0.473 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.423 ' O ' HG12 ' A' ' 42' ' ' ILE . 56.3 Cg_endo -67.55 166.37 24.14 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 121.845 1.697 . . . . 0.0 112.447 172.451 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -52.24 -31.08 30.64 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 125.457 1.503 . . . . 0.0 112.337 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -60.45 -35.75 76.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.518 1.527 . . . . 0.0 110.99 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -91.65 -14.34 30.29 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.2 1.0 . . . . 0.0 112.989 -175.073 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.423 HG12 ' O ' ' A' ' 38' ' ' PRO . 41.2 mm -88.41 153.07 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.076 0.55 . . . . 0.0 110.914 -175.45 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.484 ' HB2' ' O ' ' B' ' 24' ' ' ALA . 89.1 mt -90.85 -67.22 0.86 Allowed 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 171.842 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -82.97 134.61 46.27 Favored Pre-proline 0 CA--C 1.565 1.555 0 C-N-CA 123.001 0.521 . . . . 0.0 110.588 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . 0.431 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 88.9 Cg_endo -79.83 -32.04 1.66 Allowed 'Trans proline' 0 CA--C 1.571 2.342 0 C-N-CA 122.72 2.28 . . . . 0.0 116.072 -177.549 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.431 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.26 0.0 OUTLIER -71.42 -11.38 60.85 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -166.739 . . . . . . . . 4 4 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.499 HD11 HG13 ' A' ' 7' ' ' VAL . 2.9 mm? -53.54 -46.63 70.25 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.807 0.731 . . . . 0.0 110.203 171.278 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 98.1 t -70.26 -42.38 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.758 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -68.98 -42.43 76.55 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.406 -175.095 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.21 -30.91 71.85 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.951 0.9 . . . . 0.0 111.868 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.02 -52.27 25.49 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.015 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -81.76 -17.7 46.78 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -172.032 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -69.38 -32.38 71.37 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 117.992 0.36 . . . . 0.0 111.742 -176.268 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -91.15 147.4 23.09 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.544 0.737 . . . . 0.0 109.473 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 60.46 96.06 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.143 1.377 . . . . 0.0 111.152 -171.613 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.56 1.345 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.525 -176.549 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -107.89 62.35 0.61 Allowed 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 169.086 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.52 -174.32 4.9 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 114.326 -1.306 . . . . 0.0 109.086 -177.394 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 74.4 p 54.06 29.83 10.91 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 124.713 1.205 . . . . 0.0 111.632 -175.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . 0.481 ' HE3' ' HA ' ' B' ' 23' ' ' LYS . 0.0 OUTLIER -87.22 176.4 7.58 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.747 176.213 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . 0.484 ' O ' ' HB2' ' A' ' 43' ' ' LEU . . . -117.79 112.34 20.27 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.874 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -103.08 168.61 9.07 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 166.947 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 -145.56 163.1 35.81 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.789 0.328 . . . . 0.0 110.139 -172.488 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.67 HM33 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.544 0.712 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 56.4 m -165.8 173.31 10.77 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 122.819 0.448 . . . . 0.0 111.435 -172.926 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.77 139.59 86.31 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.054 0.941 . . . . 0.0 111.886 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 47.3 Cg_exo -59.79 -17.17 41.74 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 123.191 2.594 . . . . 0.0 113.579 174.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . 65.75 19.19 11.35 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.711 1.204 . . . . 0.0 111.654 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 43.5 p -113.64 150.34 33.31 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 124.533 1.133 . . . . 0.0 109.724 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.418 0 CA-C-O 118.73 -1.039 . . . . 0.0 111.882 177.425 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.125 0 N-CA-C 112.012 -0.435 . . . . 0.0 112.012 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 4.2 mp0 62.12 9.76 3.33 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.769 1.228 . . . . 0.0 113.754 171.514 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -93.99 142.82 26.95 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 121.338 0.59 . . . . 0.0 110.887 -169.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 39.1 t -105.33 140.31 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 114.255 -1.339 . . . . 0.0 109.371 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -132.1 152.27 51.31 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.776 0.83 . . . . 0.0 109.166 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.03 128.27 35.09 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.46 132.47 70.62 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.439 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -69.29 -61.7 1.68 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.996 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.8 p -167.59 -169.34 1.18 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.758 -172.454 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.486 HD11 ' HB3' ' A' ' 22' ' ' TYR . 51.2 mm -105.5 139.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.418 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.426 ' HB3' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -92.64 -48.5 6.56 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.676 0.791 . . . . 0.0 109.97 -179.875 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -137.53 161.47 36.31 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.395 0.678 . . . . 0.0 111.156 -176.87 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -146.22 142.91 28.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.819 0.848 . . . . 0.0 109.179 -177.4 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -165.13 143.99 6.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.788 0.835 . . . . 0.0 109.137 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.523 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 7.2 p -92.09 125.29 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.943 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -133.15 104.52 6.54 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.992 0.517 . . . . 0.0 109.611 -169.415 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 62.52 30.64 17.16 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.008 0.923 . . . . 0.0 110.656 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 -17.46 51.07 Favored Glycine 0 C--N 1.348 1.237 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.569 -174.045 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -94.87 109.99 21.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.632 0.773 . . . . 0.0 109.272 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.523 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.7 t -79.24 111.44 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.024 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -90.53 143.75 26.45 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 123.696 0.798 . . . . 0.0 109.786 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.486 ' HB3' HD11 ' A' ' 10' ' ' ILE . 98.6 m-85 -125.94 123.51 38.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.315 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.426 HD23 ' HB3' ' A' ' 11' ' ' ARG . 43.1 tp -71.47 84.23 0.82 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 169.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.587 HG23 HD11 ' A' ' 42' ' ' ILE . 99.8 t -69.09 104.37 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.086 -172.395 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -78.06 99.76 6.24 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.899 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.534 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.8 m95 -69.07 139.54 54.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.958 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.18 -31.63 70.37 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 120.718 0.294 . . . . 0.0 110.559 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.74 -26.16 47.07 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.929 -0.578 . . . . 0.0 113.616 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.534 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 94.4 m95 -110.87 138.48 21.13 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 122.968 0.507 . . . . 0.0 111.363 -172.3 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -52.95 157.65 7.72 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.526 2.817 . . . . 0.0 113.248 173.359 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -57.82 -20.24 42.77 Favored 'Trans proline' 0 C--N 1.383 2.362 0 C-N-CA 123.327 2.685 . . . . 0.0 113.925 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -80.77 -31.39 35.87 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.377 0.671 . . . . 0.0 111.434 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -88.9 -4.37 58.48 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.383 0.673 . . . . 0.0 111.174 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.8 m -68.19 137.45 54.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.216 0.607 . . . . 0.0 109.606 172.071 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.9 p -111.88 143.2 43.23 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.051 0.541 . . . . 0.0 111.826 -170.079 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -75.57 85.66 2.64 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.669 0.788 . . . . 0.0 110.145 177.633 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.502 ' HB2' HD11 ' A' ' 42' ' ' ILE . 28.1 mm-40 -102.98 128.06 28.53 Favored Pre-proline 0 C--O 1.238 0.465 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.265 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.15 162.28 40.85 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.753 1.636 . . . . 0.0 110.9 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.98 -16.48 43.45 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.984 0.514 . . . . 0.0 112.01 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -55.67 -50.84 69.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.803 1.241 . . . . 0.0 109.996 170.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -76.96 -16.67 59.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.732 -174.515 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.587 HD11 HG23 ' A' ' 24' ' ' VAL . 46.0 mm -91.43 147.03 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.207 1.003 . . . . 0.0 111.161 -172.624 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 62.6 mt -87.34 -71.12 0.58 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 122.966 0.506 . . . . 0.0 109.641 172.511 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . 0.416 ' O ' HD21 ' A' ' 47' ' ' LEU . 14.3 t70 -68.92 112.58 11.94 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 122.919 0.488 . . . . 0.0 110.024 -176.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -81.65 -9.15 12.32 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.479 2.12 . . . . 0.0 113.187 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ttp180 -70.98 -16.54 62.64 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.787 0.835 . . . . 0.0 110.081 -178.197 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.466 HD13 ' HZ2' ' B' ' 23' ' ' LYS . 4.5 mm? -49.88 -47.39 52.01 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.759 0.824 . . . . 0.0 111.513 169.28 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.9 t -67.97 -50.43 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.823 0.849 . . . . 0.0 110.615 -178.089 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.405 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 25.8 mmt -58.5 -53.27 60.19 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.072 -177.04 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.89 78.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.574 1.15 . . . . 0.0 112.164 -177.09 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -62.63 -55.11 30.1 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.548 177.341 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -74.82 -6.18 47.62 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -170.467 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.405 ' HG3' ' O ' ' A' ' 49' ' ' MET . 60.7 mt-10 -60.81 -31.2 70.6 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.02 0.438 . . . . 0.0 110.687 171.708 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 137.71 41.39 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.897 0.879 . . . . 0.0 108.817 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 65.12 98.7 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 124.122 0.969 . . . . 0.0 111.855 -175.984 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.086 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 176.303 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 . . . . . 0 N--CA 1.479 1.004 0 CA-C-O 120.989 0.423 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -112.32 135.72 52.66 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 172.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.43 -174.1 1.85 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.577 0.751 . . . . 0.0 110.253 -177.144 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.2 t -67.62 84.19 0.18 Allowed 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 122.45 1.119 . . . . 0.0 109.91 172.416 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . 0.466 ' HZ2' HD13 ' A' ' 47' ' ' LEU . 7.3 mtpm? -135.03 123.0 22.59 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-N 114.204 -1.362 . . . . 0.0 107.928 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -136.77 130.09 31.43 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.557 0.694 . . . . 0.0 110.28 -178.602 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.57 ' HB1' HD13 ' A' ' 42' ' ' ILE . . . -109.73 166.34 10.99 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.729 178.284 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -131.48 157.29 43.92 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 123.343 0.657 . . . . 0.0 109.326 -172.106 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.797 0 C-N-CA 122.95 0.5 . . . . 0.0 111.524 -179.523 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 33.3 t -159.27 138.4 11.21 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.476 0.179 . . . . 0.0 111.019 -172.878 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.6 118.81 74.15 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 123.581 0.752 . . . . 0.0 110.468 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.31 -9.28 24.67 Favored 'Trans proline' 0 C--N 1.381 2.248 0 C-N-CA 122.651 2.234 . . . . 0.0 112.602 174.84 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.89 3.55 50.97 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.937 0.895 . . . . 0.0 112.504 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 11.0 t -78.61 -28.76 45.71 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.558 0.343 . . . . 0.0 111.448 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.811 -0.994 . . . . 0.0 111.292 -176.085 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.9 0 N-CA-C 111.703 -0.559 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -158.83 93.44 1.17 Allowed 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.457 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.439 ' HB2' ' HB2' ' B' ' 27' ' ' M3L . 26.9 mp0 -112.06 90.61 3.39 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.591 0.756 . . . . 0.0 109.609 -178.293 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.523 HG23 ' HB3' ' B' ' 26' ' ' ARG . 48.4 t -85.74 103.94 13.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 123.721 0.808 . . . . 0.0 109.092 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -129.38 174.13 9.9 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.458 0.703 . . . . 0.0 110.703 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.76 114.26 20.28 Favored 'General case' 0 C--O 1.245 0.864 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.013 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.585 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.7 p -107.72 149.49 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.658 1.183 . . . . 0.0 109.93 -178.831 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.555 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 8.1 tp10 -86.02 -59.0 2.42 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.925 0.393 . . . . 0.0 109.992 174.834 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.494 ' HA ' HD13 ' A' ' 47' ' ' LEU . 15.9 p -169.6 179.89 3.61 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.77 -171.289 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.516 HD12 ' HB3' ' A' ' 22' ' ' TYR . 40.9 mm -86.64 128.61 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 172.056 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.48 ' HD2' HD22 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -76.28 -49.3 17.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.887 0.875 . . . . 0.0 109.472 176.518 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.8 tttp -148.72 164.71 33.56 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.61 0.364 . . . . 0.0 110.054 -172.483 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -142.24 154.01 44.42 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.151 0.58 . . . . 0.0 109.462 -171.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . 0.558 ' HG3' ' HB2' ' A' ' 21' ' ' GLU . 10.0 ptm180 -171.45 -174.24 1.38 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.247 1.419 . . . . 0.0 108.831 179.394 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -143.71 142.51 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.496 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -137.33 104.65 5.44 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.584 0.754 . . . . 0.0 109.069 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm 59.72 34.35 22.03 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.786 1.234 . . . . 0.0 111.302 177.869 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.79 -14.57 65.01 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 115.241 -0.89 . . . . 0.0 114.292 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -85.2 109.87 18.62 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.6 t -78.22 111.05 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -175.488 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.558 ' HB2' ' HG3' ' A' ' 14' ' ' ARG . 5.3 mm-40 -95.86 140.27 30.87 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.865 0.866 . . . . 0.0 110.575 -168.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.516 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.6 m-85 -129.99 121.52 26.69 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.871 0.868 . . . . 0.0 109.146 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.48 HD22 ' HD2' ' A' ' 11' ' ' ARG . 24.0 tp -73.68 80.06 1.53 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.3 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.581 HG22 HD13 ' A' ' 42' ' ' ILE . 40.8 t -65.17 106.18 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.525 1.13 . . . . 0.0 109.708 -175.881 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.431 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 13.7 tptm -90.3 104.61 17.17 Favored 'General case' 0 C--O 1.243 0.749 0 C-N-CA 123.239 0.615 . . . . 0.0 110.019 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.585 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 36.9 m95 -77.56 127.07 31.89 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.238 1.015 . . . . 0.0 108.937 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.555 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -64.5 -28.8 69.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -166.466 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.17 -2.81 54.46 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 116.749 -0.205 . . . . 0.0 113.209 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.58 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 76.9 m95 -111.44 150.09 41.6 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 123.642 0.777 . . . . 0.0 110.727 -173.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -64.73 158.54 50.02 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.861 2.374 . . . . 0.0 111.836 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -62.81 -18.53 64.98 Favored 'Trans proline' 0 C--N 1.378 2.103 0 C-N-CA 123.067 2.511 . . . . 0.0 113.686 -179.094 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -71.55 -30.01 65.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.573 0.349 . . . . 0.0 110.511 173.993 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.49 ' HD2' HM11 ' B' ' 27' ' ' M3L . 12.6 m-85 -86.36 -5.03 59.26 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.712 0.805 . . . . 0.0 111.862 176.982 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 t -68.92 123.88 22.19 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 170.783 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' THR . . . . . 0.402 ' HG1' ' HG2' ' A' ' 37' ' ' GLU . 17.7 p -115.87 136.74 52.75 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.119 0.967 . . . . 0.0 112.12 -165.298 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -76.5 84.92 3.21 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 172.945 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.471 ' HB2' HD13 ' A' ' 42' ' ' ILE . 49.1 mm-40 -101.05 140.4 21.27 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 123.358 0.663 . . . . 0.0 109.222 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -78.48 158.97 29.07 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 121.794 1.663 . . . . 0.0 111.602 174.304 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -54.9 -25.01 26.27 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 123.907 0.883 . . . . 0.0 112.083 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -59.3 -31.46 69.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.685 1.194 . . . . 0.0 112.077 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.512 ' HB3' ' HB2' ' B' ' 28' ' ' SER . 14.8 m-70 -127.83 25.0 6.02 Favored 'General case' 0 C--O 1.25 1.083 0 C-N-CA 123.753 0.821 . . . . 0.0 112.538 -170.198 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.581 HD13 HG22 ' A' ' 24' ' ' VAL . 37.5 mm -103.9 150.8 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 125.041 1.336 . . . . 0.0 110.293 168.934 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.494 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 4.9 tt -81.23 -82.57 0.12 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.225 1.01 . . . . 0.0 108.826 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -78.5 132.51 65.35 Favored Pre-proline 0 CA--C 1.559 1.31 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -80.45 -16.82 10.46 Favored 'Trans proline' 0 C--N 1.377 2.028 0 C-N-CA 122.57 2.18 . . . . 0.0 113.711 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.447 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 65.1 mtm180 -71.98 -11.12 60.62 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.866 0.866 . . . . 0.0 113.203 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.494 HD13 ' HA ' ' A' ' 9' ' ' SER . 3.1 mm? -58.7 -44.49 90.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 118.774 0.715 . . . . 0.0 109.812 167.657 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.37 -44.21 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.386 1.074 . . . . 0.0 110.52 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.447 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 96.0 mmm -65.25 -51.64 59.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.196 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.68 70.49 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.955 0.902 . . . . 0.0 111.547 179.029 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -65.92 -49.17 68.91 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.001 0.521 . . . . 0.0 110.304 175.572 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.17 -5.71 59.29 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.679 0.792 . . . . 0.0 112.28 -177.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -66.63 -29.12 69.08 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.592 0.757 . . . . 0.0 110.191 168.434 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.442 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 3.0 mptp? -101.57 150.85 22.65 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.85 0.86 . . . . 0.0 109.87 178.672 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 57.16 77.88 0.25 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.057 1.343 . . . . 0.0 111.879 178.194 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 . . . . . 0 C--O 1.253 1.271 0 CA-C-O 119.043 -0.503 . . . . 0.0 109.98 178.029 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.81 0.338 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 48.3 mt -87.81 136.17 33.07 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.708 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.483 ' HB2' ' O ' ' A' ' 8' ' ' GLU . . . -77.95 -27.48 49.28 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.217 0.607 . . . . 0.0 110.985 -177.625 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 10.2 t 42.06 67.24 0.6 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 125.665 1.586 . . . . 0.0 114.095 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -128.29 159.12 36.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.182 0.993 . . . . 0.0 110.427 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.2 134.31 47.65 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 171.657 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.54 -175.6 2.98 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 171.533 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.523 ' HB3' HG23 ' A' ' 4' ' ' VAL . 4.5 ptp180 -143.58 141.53 30.69 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.4 0.68 . . . . 0.0 109.591 -178.248 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.49 HM11 ' HD2' ' A' ' 33' ' ' TYR . . . . . . . . 0 C--O 1.237 0.42 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 168.153 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.512 ' HB2' ' HB3' ' A' ' 41' ' ' HIS . 69.5 m -85.55 128.51 34.77 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 175.133 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.04 128.66 92.64 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 123.481 0.712 . . . . 0.0 111.478 -171.316 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.1 97.42 0.66 Allowed 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 122.168 1.912 . . . . 0.0 110.189 168.231 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -57.55 -32.42 67.09 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.712 0.805 . . . . 0.0 110.641 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 24.5 m -101.79 103.04 13.74 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 166.516 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.67 -1.072 . . . . 0.0 110.706 174.527 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.462 0 N-CA-C 112.251 -0.34 . . . . 0.0 112.251 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.438 ' HG3' ' NH2' ' B' ' 26' ' ' ARG . 1.2 pm0 -109.68 138.87 45.42 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.419 1.088 . . . . 0.0 109.277 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -159.29 150.65 20.15 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.95 0.5 . . . . 0.0 111.538 -170.828 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.9 t -100.66 140.12 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 124.189 0.995 . . . . 0.0 110.549 -177.337 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -142.28 163.28 33.29 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.062 0.945 . . . . 0.0 110.195 171.854 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.84 153.55 36.75 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.013 174.475 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.461 HG11 ' HB3' ' B' ' 25' ' ' ALA . 7.3 p -155.31 153.56 7.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.645 0 C-N-CA 124.311 1.045 . . . . 0.0 108.415 -176.457 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -121.9 -36.77 2.95 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.722 175.179 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -133.75 138.86 46.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.561 -166.06 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.8 mm -91.08 111.82 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 161.864 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.98 -54.19 14.38 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.708 0.63 . . . . 0.0 109.997 -173.943 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 99.2 mttt -139.2 176.84 8.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.823 0.849 . . . . 0.0 110.568 -178.472 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -157.91 143.16 16.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.215 1.006 . . . . 0.0 108.933 -173.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -155.51 166.02 34.8 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.085 0.954 . . . . 0.0 108.582 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.4 t -127.86 114.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.418 ' HD3' ' OE1' ' A' ' 21' ' ' GLU . 74.5 mtp180 -125.34 115.95 21.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 123.983 0.913 . . . . 0.0 108.92 -178.566 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt 64.21 24.76 13.47 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 125.458 1.503 . . . . 0.0 111.55 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.04 -16.04 60.5 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.755 -177.491 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.831 -0.804 . . . . 0.0 108.831 178.254 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 t -82.65 109.09 16.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.379 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.483 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 50.9 mt-10 -94.81 141.47 28.59 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.801 0.84 . . . . 0.0 110.279 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -120.18 120.49 36.31 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.784 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 33.9 tp -71.58 86.97 0.9 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.799 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.6 t -73.17 107.98 4.19 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.976 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.445 ' O ' HG21 ' A' ' 7' ' ' VAL . 20.5 tptm -78.69 99.89 6.81 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 175.945 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 68.0 m95 -69.94 129.67 40.12 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 175.202 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -20.59 62.2 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.006 0.366 . . . . 0.0 111.329 -176.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -99.05 7.46 60.47 Favored Glycine 0 C--N 1.354 1.57 0 C-N-CA 123.338 0.494 . . . . 0.0 113.626 178.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -133.7 141.1 38.78 Favored Pre-proline 0 N--CA 1.486 1.374 0 C-N-CA 123.639 0.776 . . . . 0.0 109.529 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -62.84 159.32 38.28 Favored 'Trans proline' 0 CA--C 1.565 2.031 0 C-N-CA 122.214 1.943 . . . . 0.0 110.717 168.287 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.22 0.56 4.41 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.083 2.522 . . . . 0.0 114.221 -174.018 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.568 ' HZ2' ' HB3' ' A' ' 32' ' ' LYS . 0.2 OUTLIER -77.09 -14.56 59.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.237 0.615 . . . . 0.0 111.562 170.651 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -119.27 7.25 11.24 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.663 0.785 . . . . 0.0 111.052 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.4 p -69.27 122.58 19.16 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 28.9 p -101.44 143.71 31.13 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.329 0.652 . . . . 0.0 111.314 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -76.82 86.35 3.41 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -94.5 113.08 60.1 Favored Pre-proline 0 N--CA 1.472 0.632 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 174.874 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.483 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 36.7 Cg_endo -64.71 172.48 6.86 Favored 'Trans proline' 0 C--N 1.371 1.728 0 C-N-CA 121.787 1.658 . . . . 0.0 113.616 175.703 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . 0.497 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 11.4 pt-20 -43.75 -41.86 5.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 126.696 1.998 . . . . 0.0 114.156 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . 0.497 ' HG3' ' HG3' ' A' ' 39' ' ' GLU . 24.2 mt-10 -75.09 -29.57 60.68 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.694 1.198 . . . . 0.0 111.015 -176.588 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.464 ' CD2' ' HA ' ' B' ' 28' ' ' SER . 2.2 m80 -86.46 -2.96 58.9 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.405 1.082 . . . . 0.0 112.858 -172.171 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.87 149.73 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 124.889 1.276 . . . . 0.0 110.471 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.528 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 30.5 mt -81.98 -77.62 0.22 Allowed 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 167.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -68.31 110.53 5.89 Favored Pre-proline 0 C--N 1.362 1.12 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -170.357 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.68 -22.7 23.75 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.425 2.083 . . . . 0.0 112.076 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . 0.574 ' HB2' ' HZ3' ' B' ' 23' ' ' LYS . 78.3 mtm180 -70.81 -14.83 62.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.597 0.759 . . . . 0.0 111.443 -177.814 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.6 mt -57.29 -46.51 83.08 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.713 0.805 . . . . 0.0 111.227 170.846 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -63.05 -53.18 49.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.754 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.455 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 1.3 mpt? -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.23 0.956 . . . . 0.0 111.141 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.4 99.43 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.956 0.902 . . . . 0.0 110.74 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -63.84 -42.24 97.64 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.175 0.99 . . . . 0.0 110.391 174.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.619 ' HA ' ' HB2' ' A' ' 55' ' ' GLU . 59.0 mt-10 -76.12 -10.44 59.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.758 0.823 . . . . 0.0 112.953 -174.487 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.455 ' HG3' ' O ' ' A' ' 49' ' ' MET . 52.0 mt-10 -65.1 -29.94 70.84 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.473 0.309 . . . . 0.0 110.967 172.904 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.441 ' HZ1' ' HB2' ' A' ' 53' ' ' GLU . 0.0 OUTLIER -133.64 30.94 3.73 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.671 0.788 . . . . 0.0 110.24 -177.234 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.619 ' HB2' ' HA ' ' A' ' 52' ' ' GLU . 39.2 tt0 -74.25 88.28 2.0 Allowed 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 176.624 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 . . . . . 0 CA--C 1.558 1.256 0 C-N-CA 124.443 1.097 . . . . 0.0 108.84 -178.137 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 120.973 0.416 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 62.1 mt -72.19 -34.66 68.57 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.804 0.842 . . . . 0.0 110.72 179.354 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.04 130.52 37.76 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.299 0.639 . . . . 0.0 109.689 176.977 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 11.9 t -94.84 5.19 52.61 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.888 0.875 . . . . 0.0 111.833 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . 0.574 ' HZ3' ' HB2' ' A' ' 46' ' ' ARG . 27.7 mtpp -50.92 142.69 11.35 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 124.969 1.308 . . . . 0.0 111.905 -175.413 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -109.63 116.23 31.35 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.925 0.49 . . . . 0.0 110.42 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.461 ' HB3' HG11 ' A' ' 7' ' ' VAL . . . -94.54 -173.33 3.0 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 167.246 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.528 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 15.3 ttt180 -153.06 146.1 24.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.26 -176.127 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.553 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 166.918 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.464 ' HA ' ' CD2' ' A' ' 41' ' ' HIS . 51.1 m 94.4 158.17 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.512 1.525 . . . . 0.0 111.679 170.323 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.42 153.31 95.08 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 123.959 0.904 . . . . 0.0 112.391 -172.455 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -52.04 117.11 3.26 Favored 'Trans proline' 0 C--N 1.379 2.143 0 C-N-CA 123.353 2.702 . . . . 0.0 112.853 173.662 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.64 89.45 7.73 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.636 0.774 . . . . 0.0 109.964 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 23.8 m -73.19 130.31 39.97 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.54 0.736 . . . . 0.0 111.256 -176.645 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.317 0 CA-C-O 119.343 -0.698 . . . . 0.0 113.816 -177.842 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.445 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.42 164.06 18.12 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.319 0.648 . . . . 0.0 109.683 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -89.47 104.14 16.72 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.513 0.725 . . . . 0.0 111.603 -166.749 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.79 139.73 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.504 1.122 . . . . 0.0 108.611 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -137.79 167.61 21.37 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.777 . . . . 0.0 109.989 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.06 124.5 25.09 Favored 'General case' 0 C--O 1.248 0.974 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.519 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.435 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -110.25 145.29 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.655 0.782 . . . . 0.0 110.534 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -90.0 -46.12 8.72 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.27 1.028 . . . . 0.0 110.763 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.4 p -175.46 -170.12 0.4 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.487 0.715 . . . . 0.0 110.663 -172.254 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.422 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.3 mm -111.79 120.98 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 168.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.412 ' HB3' HD22 ' A' ' 23' ' ' LEU . 0.4 OUTLIER -74.31 -56.25 5.09 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.077 0.951 . . . . 0.0 109.677 -179.313 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 33.6 mtmm -137.61 176.52 8.63 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.962 0.905 . . . . 0.0 111.066 -179.209 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -156.99 152.53 26.73 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.756 1.222 . . . . 0.0 108.448 -173.157 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -165.7 164.15 19.0 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.452 0.701 . . . . 0.0 109.723 177.216 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.473 HG21 HG22 ' A' ' 20' ' ' VAL . 38.6 t -108.87 126.92 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 166.2 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -139.0 105.77 5.38 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.413 1.085 . . . . 0.0 108.94 -170.334 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 62.26 26.86 16.11 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.375 1.07 . . . . 0.0 111.623 -176.278 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.08 -15.46 62.83 Favored Glycine 0 C--N 1.348 1.205 0 CA-C-N 115.733 -0.667 . . . . 0.0 113.175 -176.215 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.257 0.623 . . . . 0.0 110.009 178.631 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.473 HG22 HG21 ' A' ' 15' ' ' VAL . 43.7 t -76.21 104.47 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 175.751 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 66.3 mt-10 -98.62 149.29 22.93 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.527 0.731 . . . . 0.0 110.679 -176.014 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.422 ' HB3' HD12 ' A' ' 10' ' ' ILE . 92.8 m-85 -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.175 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . 0.412 HD22 ' HB3' ' A' ' 11' ' ' ARG . 36.4 tp -70.12 86.71 0.56 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.028 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.419 HG21 HD13 ' A' ' 42' ' ' ILE . 75.7 t -70.63 107.35 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.106 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -79.79 102.07 8.85 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.54 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.0 m95 -77.28 154.27 33.1 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.648 -177.399 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -76.74 -33.25 58.13 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.419 0.687 . . . . 0.0 109.662 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.26 -25.51 28.42 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.529 -0.759 . . . . 0.0 113.414 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.54 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 97.6 m95 -106.54 135.22 19.53 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-N 117.338 0.569 . . . . 0.0 111.424 -176.564 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -53.98 158.76 8.38 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.461 2.774 . . . . 0.0 113.098 170.71 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -63.68 -16.81 56.96 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 123.225 2.617 . . . . 0.0 113.621 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -79.95 -36.72 35.77 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.884 0.474 . . . . 0.0 110.858 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -83.6 -5.76 59.26 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.322 0.649 . . . . 0.0 111.37 177.552 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.8 m -66.58 134.73 52.95 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 169.913 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.7 p -120.4 159.27 25.44 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.295 0.638 . . . . 0.0 111.824 -169.36 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.02 84.51 6.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.928 0.891 . . . . 0.0 110.464 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -101.34 111.79 64.16 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.44 177.121 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 30.4 Cg_endo -61.57 165.51 13.33 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 122.135 1.89 . . . . 0.0 112.326 172.36 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -60.16 -21.45 61.67 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.216 1.007 . . . . 0.0 112.734 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.38 -33.04 71.89 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.249 1.02 . . . . 0.0 111.017 173.821 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.61 ' HA ' ' HB3' ' B' ' 28' ' ' SER . 2.0 m80 -83.26 -29.88 28.07 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.538 -175.632 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.477 HD12 ' HB1' ' B' ' 25' ' ' ALA . 40.1 mm -88.83 144.87 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.936 0.895 . . . . 0.0 111.949 -165.817 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.0 mt -85.31 -72.79 0.47 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.426 0.69 . . . . 0.0 111.061 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.09 131.99 77.66 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -78.53 -18.63 12.05 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.666 2.244 . . . . 0.0 114.027 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -71.71 -13.19 61.65 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -172.03 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . 0.412 HD11 HG12 ' A' ' 7' ' ' VAL . 2.6 mm? -61.6 -47.38 85.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 168.223 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . 0.478 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 91.5 t -64.21 -46.54 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.649 176.895 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.2 mmt -57.82 -39.71 78.25 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.674 0.789 . . . . 0.0 111.566 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.25 85.24 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.201 1.0 . . . . 0.0 110.885 177.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.416 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 68.1 t80 -73.14 -35.98 66.6 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.716 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.478 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 35.9 mm-40 -69.86 -13.1 62.1 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.193 0.597 . . . . 0.0 112.271 -175.527 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -71.84 -9.05 57.76 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.583 0.753 . . . . 0.0 112.784 179.085 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.67 174.95 9.22 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.539 1.136 . . . . 0.0 109.733 173.94 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 54.0 22.72 3.57 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 126.451 1.9 . . . . 0.0 111.832 -166.061 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 CA--C 1.562 1.425 0 C-N-CA 125.064 1.346 . . . . 0.0 111.845 -171.526 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 92.5 mt -122.43 97.94 5.7 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 173.73 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.77 154.09 30.25 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.146 0.578 . . . . 0.0 110.046 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 14.3 t -130.61 25.34 5.08 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.785 0.834 . . . . 0.0 109.444 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -78.07 -174.76 3.76 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.598 -173.286 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.82 108.02 18.67 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.804 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.477 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.06 155.42 16.81 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 163.027 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.628 ' HE ' ' HB2' ' B' ' 28' ' ' SER . 7.5 ttt180 -141.45 154.24 45.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -169.6 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.238 0.471 0 C-N-CA 124.635 1.174 . . . . 0.0 108.451 176.617 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 28' ' ' SER . . . . . 0.628 ' HB2' ' HE ' ' B' ' 26' ' ' ARG . 8.6 t -72.25 83.02 1.03 Allowed 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.011 175.833 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.04 140.95 86.86 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 124.274 1.029 . . . . 0.0 111.381 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -74.04 -7.57 20.05 Favored 'Trans proline' 0 C--N 1.375 1.937 0 C-N-CA 122.348 2.032 . . . . 0.0 112.967 -174.862 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . 65.88 -72.06 0.08 Allowed 'General case' 0 C--N 1.36 1.042 0 C-N-CA 125.442 1.497 . . . . 0.0 111.354 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 15.4 t -72.9 141.15 47.88 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.335 0.654 . . . . 0.0 110.125 173.344 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.241 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -176.335 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.937 0 N-CA-C 112.102 -0.399 . . . . 0.0 112.102 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.465 ' HG3' ' HD2' ' B' ' 26' ' ' ARG . 0.0 OUTLIER -153.65 -171.68 3.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.505 0.722 . . . . 0.0 109.6 177.752 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . 0.427 ' HB2' ' HB2' ' B' ' 27' ' ' M3L . 1.7 mp0 -81.39 82.19 7.29 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 123.679 0.792 . . . . 0.0 111.084 -172.652 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.5 t -112.47 124.84 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.389 1.076 . . . . 0.0 108.345 172.927 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . 0.483 ' HE2' HM21 ' B' ' 27' ' ' M3L . 94.4 m-85 -135.23 162.29 32.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.7 0.8 . . . . 0.0 109.623 178.078 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.91 107.06 5.09 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.448 0.699 . . . . 0.0 109.197 175.381 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . 0.527 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.1 p -85.43 135.0 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.09 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . 0.517 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.8 tp10 -69.11 -50.4 48.44 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.157 0.583 . . . . 0.0 109.758 175.031 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 p 178.76 -175.89 0.22 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.526 1.53 . . . . 0.0 108.853 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . 0.495 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -85.62 122.77 38.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.05 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.607 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.5 tmt_? -67.82 -56.05 10.63 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.337 1.055 . . . . 0.0 109.194 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.403 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.8 mttt -140.81 157.92 44.7 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.116 -176.984 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -139.32 143.67 37.95 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.269 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -169.04 138.1 2.1 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.902 0.751 . . . . 0.0 109.924 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -86.16 124.28 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.196 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -127.07 105.2 8.42 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.483 1.113 . . . . 0.0 109.156 -173.189 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 59.51 32.95 22.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.57 1.148 . . . . 0.0 111.087 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.92 2.65 83.85 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.588 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.513 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -107.14 111.63 24.14 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.444 0.698 . . . . 0.0 109.827 174.627 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 t -74.18 110.52 8.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -93.7 144.04 25.76 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.156 0.982 . . . . 0.0 109.386 -173.493 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . 0.495 ' HB3' HD12 ' A' ' 10' ' ' ILE . 94.6 m-85 -128.86 109.36 11.2 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.617 0.767 . . . . 0.0 109.097 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.8 tp -67.36 97.11 0.54 Allowed 'General case' 0 C--N 1.345 0.388 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.467 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.1 t -76.47 105.93 5.86 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 C-N-CA 123.768 0.827 . . . . 0.0 110.131 -173.798 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.607 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.1 tptp -82.24 100.12 9.7 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.645 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 46.2 m95 -69.04 140.64 54.94 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . 0.517 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.8 ttpt -59.98 -50.84 72.16 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 123.585 0.553 . . . . 0.0 111.874 -172.038 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.85 -28.41 31.81 Favored Glycine 0 C--N 1.341 0.819 0 CA-C-N 115.921 -0.581 . . . . 0.0 113.343 -177.784 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.645 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 58.1 m95 -89.26 123.83 66.12 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.713 0.405 . . . . 0.0 110.147 -175.318 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . 0.471 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 72.4 Cg_exo -53.76 164.92 2.05 Favored 'Trans proline' 0 C--N 1.38 2.205 0 C-N-CA 123.645 2.897 . . . . 0.0 113.979 174.749 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.75 -23.56 33.96 Favored 'Trans proline' 0 C--N 1.387 2.584 0 C-N-CA 123.674 2.916 . . . . 0.0 114.855 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . 0.471 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.4 pttt -66.3 -33.0 74.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.227 0.611 . . . . 0.0 112.124 176.021 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . 0.449 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 75.0 m-85 -91.35 -13.39 32.6 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.274 0.63 . . . . 0.0 111.544 176.555 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.8 m -66.92 130.77 44.23 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.338 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.0 p -119.47 145.04 46.64 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.477 0.711 . . . . 0.0 111.164 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -76.2 79.51 3.0 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.575 0.75 . . . . 0.0 110.252 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -93.18 113.67 60.64 Favored Pre-proline 0 C--O 1.236 0.373 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 175.47 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.59 178.5 4.41 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.595 1.53 . . . . 0.0 113.271 -178.967 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -38.18 -42.71 0.7 Allowed 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 127.186 2.194 . . . . 0.0 115.214 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.91 -20.67 52.44 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.517 0.727 . . . . 0.0 111.995 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -112.73 16.78 19.5 Favored 'General case' 0 C--O 1.253 1.276 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -164.809 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 32.3 mm -101.69 152.64 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 125.474 1.51 . . . . 0.0 109.213 172.92 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.4 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 91.1 mt -83.45 -73.89 0.39 Allowed 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.08 0.4 . . . . 0.0 110.817 176.094 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.79 118.3 70.02 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.0 -19.92 26.07 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.557 2.171 . . . . 0.0 112.724 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -10.08 59.25 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.326 178.131 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -49.14 -42.04 38.25 Favored 'General case' 0 N--CA 1.507 2.392 0 CA-C-N 119.248 0.931 . . . . 0.0 110.412 167.489 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -51.57 57.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.918 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mmt -55.27 -42.36 73.46 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.856 0.862 . . . . 0.0 111.49 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . 0.461 ' HB3' ' O ' ' B' ' 19' ' ' GLN . . . -66.65 -39.43 88.22 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.871 1.268 . . . . 0.0 111.339 -175.892 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.68 -46.76 35.76 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.47 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . 0.41 ' HA ' ' HG2' ' A' ' 55' ' ' GLU . 62.5 mt-10 -68.71 -6.3 25.46 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.449 0.7 . . . . 0.0 112.793 -170.957 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -63.08 -18.14 63.06 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.524 0.73 . . . . 0.0 112.006 168.78 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -79.87 -49.77 11.46 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.221 0.608 . . . . 0.0 110.324 177.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . 0.41 ' HG2' ' HA ' ' A' ' 52' ' ' GLU . 11.9 pt-20 -77.89 159.8 28.67 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.258 0.623 . . . . 0.0 110.101 177.144 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.549 -0.738 . . . . 0.0 109.408 -177.284 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . 0.461 ' O ' ' HB3' ' A' ' 50' ' ' ALA . 58.8 tp60 . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 42.1 mt -69.62 104.23 2.32 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 171.167 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . 0.429 ' O ' ' HG3' ' B' ' 23' ' ' LYS . . . -134.3 140.87 46.7 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.093 0.957 . . . . 0.0 109.611 -174.672 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 52.4 p -75.46 106.89 7.24 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.65 0.78 . . . . 0.0 110.571 -175.336 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' B' ' 21' ' ' ALA . 22.8 mtpp -118.21 -165.92 1.16 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.389 1.076 . . . . 0.0 110.081 -174.123 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.18 125.77 53.8 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.31 0.644 . . . . 0.0 110.117 174.202 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.59 175.51 9.1 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 124.189 0.996 . . . . 0.0 108.508 171.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.465 ' HD2' ' HG3' ' A' ' 2' ' ' GLU . 45.0 ttp180 -144.85 150.1 36.53 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.065 0.546 . . . . 0.0 110.706 -173.455 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . 0.483 HM21 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.241 0.652 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 165.236 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 42.3 t -76.78 82.95 3.38 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.93 142.69 90.97 Favored Pre-proline 0 CA--C 1.549 0.926 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.029 -171.386 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.96 156.88 52.0 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.662 2.241 . . . . 0.0 112.308 177.136 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.3 -54.51 5.42 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.283 0.633 . . . . 0.0 109.46 175.573 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 44.3 p -124.82 -32.19 3.09 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.489 1.115 . . . . 0.0 110.218 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.528 0 CA-C-O 118.866 -0.963 . . . . 0.0 112.67 -173.525 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.597 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -87.99 134.29 33.76 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.234 1.014 . . . . 0.0 109.453 -172.793 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -64.33 116.79 6.4 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.343 1.057 . . . . 0.0 113.196 -163.038 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.3 t -116.67 140.8 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.963 1.305 . . . . 0.0 108.584 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -141.31 158.63 43.63 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.53 0.732 . . . . 0.0 110.373 171.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.75 114.87 11.36 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.588 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -87.27 138.76 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.345 1.058 . . . . 0.0 110.249 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -76.28 -57.4 3.89 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 122.922 0.489 . . . . 0.0 109.821 175.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.0 m -157.16 170.95 21.33 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.013 0.925 . . . . 0.0 110.16 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.2 mm -89.28 110.9 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 162.992 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.51 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.6 tmt_? -66.37 -58.46 5.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.348 1.059 . . . . 0.0 109.198 -177.846 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' LYS . . . . . 0.471 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.5 mtpp -137.58 170.88 15.31 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.774 0.83 . . . . 0.0 111.444 -177.68 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -156.68 129.4 7.7 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.432 1.093 . . . . 0.0 108.898 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -157.84 150.72 22.94 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.682 0.793 . . . . 0.0 109.235 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' VAL . . . . . 0.456 HG23 HG21 ' A' ' 20' ' ' VAL . 47.2 t -93.43 112.68 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 173.341 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -107.2 96.83 6.7 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.761 1.224 . . . . 0.0 108.751 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.3 tptt 62.11 49.28 4.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.645 1.178 . . . . 0.0 110.938 176.932 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 81.82 -18.28 12.94 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.677 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -86.68 110.54 19.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.005 0.922 . . . . 0.0 109.57 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' VAL . . . . . 0.456 HG21 HG23 ' A' ' 15' ' ' VAL . 21.4 t -78.71 103.75 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -98.41 144.95 27.22 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.235 1.014 . . . . 0.0 110.554 -173.546 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -126.32 119.92 28.59 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.089 0.956 . . . . 0.0 108.602 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.3 tp -70.72 90.81 0.79 Allowed 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 169.615 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.492 HG22 HD11 ' A' ' 42' ' ' ILE . 63.7 t -78.02 105.26 6.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 123.697 0.799 . . . . 0.0 109.95 -173.545 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.51 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.4 tptp -77.41 103.55 7.4 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.45 0.7 . . . . 0.0 109.14 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' TRP . . . . . 0.508 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -77.04 157.32 31.2 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 110.111 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -64.55 -41.98 95.98 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.931 0.492 . . . . 0.0 111.098 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.0 -24.39 35.08 Favored Glycine 0 C--N 1.346 1.098 0 CA-C-N 115.935 -0.575 . . . . 0.0 113.597 -177.152 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' TRP . . . . . 0.508 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 77.0 m95 -104.45 124.59 36.67 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 122.906 0.482 . . . . 0.0 111.055 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -52.98 163.66 1.99 Allowed 'Trans proline' 0 C--N 1.386 2.524 0 C-N-CA 124.056 3.17 . . . . 0.0 113.363 171.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -62.84 -26.64 74.77 Favored 'Trans proline' 0 C--N 1.385 2.497 0 C-N-CA 123.08 2.52 . . . . 0.0 113.448 -174.827 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -78.47 -26.25 46.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.069 0.548 . . . . 0.0 111.278 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 87.3 m-85 -92.75 2.11 56.92 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.838 0.855 . . . . 0.0 111.391 175.041 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.0 m -76.3 155.73 34.0 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.369 0.667 . . . . 0.0 110.347 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.3 p -115.35 135.43 54.14 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.258 0.623 . . . . 0.0 112.481 -171.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -74.95 82.49 2.2 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.91 0.884 . . . . 0.0 110.286 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -106.06 123.07 40.26 Favored Pre-proline 0 N--CA 1.465 0.299 0 C-N-CA 123.751 0.82 . . . . 0.0 109.432 178.326 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' PRO . . . . . 0.525 ' O ' HG12 ' A' ' 42' ' ' ILE . 38.3 Cg_endo -64.19 165.05 20.6 Favored 'Trans proline' 0 C--N 1.368 1.6 0 C-N-CA 122.361 2.04 . . . . 0.0 112.15 173.393 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -56.43 -27.92 57.97 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.192 0.997 . . . . 0.0 111.021 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -55.5 -45.26 77.06 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.604 1.561 . . . . 0.0 111.226 169.514 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' HIS . . . . . 0.423 ' HE1' ' HG3' ' B' ' 30' ' ' PRO . 42.5 m170 -88.13 -7.29 57.15 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.066 0.946 . . . . 0.0 113.169 -176.177 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' ILE . . . . . 0.602 HD13 ' HB1' ' B' ' 25' ' ' ALA . 41.8 mm -94.26 139.22 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.814 0.846 . . . . 0.0 109.833 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' LEU . . . . . 0.563 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 94.9 mt -71.48 -64.76 0.86 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.833 0.453 . . . . 0.0 110.078 175.941 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.69 109.99 22.04 Favored Pre-proline 0 CA--C 1.556 1.184 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.161 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.8 -9.89 19.78 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.782 2.321 . . . . 0.0 112.704 -176.281 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 -72.89 -12.63 61.04 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.311 0.644 . . . . 0.0 111.341 -176.906 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.89 -43.38 86.07 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.914 0.486 . . . . 0.0 110.975 169.134 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.6 t -64.81 -42.05 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.693 0.797 . . . . 0.0 109.938 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' MET . . . . . 0.401 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 24.7 mmt -60.36 -47.49 85.81 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.276 177.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.9 80.4 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.507 1.123 . . . . 0.0 111.565 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' TYR . . . . . 0.425 ' O ' ' HG3' ' A' ' 54' ' ' LYS . 87.7 t80 -68.08 -34.08 75.75 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.89 0.876 . . . . 0.0 110.774 176.005 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -90.79 -9.06 47.95 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.932 0.493 . . . . 0.0 111.881 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 49' ' ' MET . 30.0 mm-40 -64.82 -42.98 94.55 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.933 0.493 . . . . 0.0 110.02 171.456 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.425 ' HG3' ' O ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -80.14 -35.71 36.24 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.993 175.269 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -67.52 143.64 56.05 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.193 0.597 . . . . 0.0 110.065 -175.39 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 . . . . . 0 CA--C 1.556 1.178 0 C-N-CA 123.28 0.632 . . . . 0.0 110.014 -176.096 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 . . . . . 0 C--O 1.242 0.697 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 8.7 tt -80.57 128.94 34.18 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.5 88.33 0.21 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.614 0.766 . . . . 0.0 110.306 -179.199 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 17.4 m -80.9 77.47 7.78 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.939 0.876 . . . . 0.0 110.834 -172.297 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.09 173.6 11.06 Favored 'General case' 0 C--O 1.248 0.991 0 C-N-CA 125.346 1.458 . . . . 0.0 107.539 170.195 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -113.76 112.02 22.73 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.423 0.63 . . . . 0.0 110.63 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 25' ' ' ALA . . . . . 0.602 ' HB1' HD13 ' A' ' 42' ' ' ILE . . . -85.87 168.94 13.77 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.464 165.656 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 26' ' ' ARG . . . . . 0.563 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 23.1 ttt180 -140.47 149.66 42.81 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.488 0.661 . . . . 0.0 111.289 -175.096 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.717 0 N-CA-C 107.778 -1.194 . . . . 0.0 107.778 166.143 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.9 t -64.95 112.83 3.48 Favored 'General case' 0 C--N 1.356 0.879 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.73 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.93 121.67 77.07 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.252 1.021 . . . . 0.0 110.922 -170.028 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 30' ' ' PRO . . . . . 0.423 ' HG3' ' HE1' ' A' ' 41' ' ' HIS . 7.5 Cg_exo -70.71 124.0 10.3 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.488 2.125 . . . . 0.0 110.839 174.955 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.33 106.02 0.69 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.489 0.716 . . . . 0.0 109.507 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 60.6 p 56.52 18.37 3.51 Favored 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 125.737 1.615 . . . . 0.0 112.854 -175.889 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.03 0 CA-C-O 119.229 -0.762 . . . . 0.0 111.741 -179.413 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' GLN . . . . . 0.425 ' HB3' ' HE2' ' A' ' 5' ' ' PHE . 1.3 mp0 . . . . . 0 CA--C 1.543 0.7 0 CA-C-O 121.211 0.529 . . . . 0.0 109.593 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 71.3 t -82.51 120.8 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 109.622 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.425 ' HE2' ' HB3' ' A' ' 3' ' ' GLN . 86.8 m-85 -137.14 161.91 34.85 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.736 0.814 . . . . 0.0 109.676 178.367 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.89 129.87 37.64 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 174.654 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.419 HG13 HD11 ' A' ' 47' ' ' LEU . 2.7 p -111.25 143.11 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.507 1.123 . . . . 0.0 110.418 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.0 -58.99 2.96 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.468 1.107 . . . . 0.0 109.378 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.9 p -174.14 -172.28 0.69 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.402 1.081 . . . . 0.0 109.775 -176.141 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.444 HD12 ' HB3' ' A' ' 22' ' ' TYR . 48.2 mm -98.01 120.07 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.558 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -73.68 -53.93 9.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.127 0.971 . . . . 0.0 109.552 179.812 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.476 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 99.0 mttt -138.05 174.45 10.55 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.916 0.886 . . . . 0.0 111.342 -176.508 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -154.55 144.79 21.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.35 1.06 . . . . 0.0 108.724 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -161.45 -179.2 7.16 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.984 0.914 . . . . 0.0 109.538 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 41.2 t -135.14 118.76 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -136.83 129.85 30.95 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.333 1.053 . . . . 0.0 109.274 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm 62.68 24.92 14.84 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.994 0.918 . . . . 0.0 111.63 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.04 -8.44 60.42 Favored Glycine 0 C--N 1.352 1.424 0 CA-C-N 115.816 -0.629 . . . . 0.0 113.232 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -85.87 117.99 25.07 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 123.84 0.856 . . . . 0.0 108.935 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.7 t -79.09 104.8 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -97.68 139.08 34.11 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.946 0.898 . . . . 0.0 110.139 -170.596 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.444 ' HB3' HD12 ' A' ' 10' ' ' ILE . 15.1 m-85 -118.13 121.3 40.18 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.452 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 28.0 tp -74.8 94.64 2.79 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 172.51 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.8 t -76.69 105.98 6.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.622 0.769 . . . . 0.0 109.97 -174.828 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.491 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.0 tptp -81.65 106.92 13.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.053 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.621 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 77.4 m95 -77.16 149.97 35.56 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.571 0.748 . . . . 0.0 110.787 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -77.44 -34.06 54.63 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.076 0.55 . . . . 0.0 111.322 -174.131 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.51 15.31 42.13 Favored Glycine 0 C--N 1.343 0.944 0 CA-C-N 116.229 -0.442 . . . . 0.0 113.008 -178.684 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.621 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 88.8 m95 -133.48 136.83 27.69 Favored Pre-proline 0 C--O 1.246 0.887 0 C-N-CA 123.125 0.57 . . . . 0.0 110.067 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.443 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 88.4 Cg_exo -52.21 158.05 5.72 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 123.355 2.704 . . . . 0.0 113.333 167.965 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.42 5.54 1.53 Allowed 'Trans proline' 0 C--N 1.377 2.049 0 C-N-CA 123.406 2.737 . . . . 0.0 114.603 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.443 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.0 pttt -90.03 -15.88 30.91 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.779 0.431 . . . . 0.0 110.923 170.106 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 97.7 m-85 -96.32 -2.6 45.47 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.54 0.736 . . . . 0.0 111.441 174.298 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -63.53 122.52 16.49 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.069 0.547 . . . . 0.0 110.727 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.8 p -102.43 135.91 43.21 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.74 0.816 . . . . 0.0 111.366 -172.057 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -76.33 75.37 3.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.276 0.63 . . . . 0.0 109.494 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -90.65 117.95 68.33 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.19 169.16 15.78 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 121.996 1.797 . . . . 0.0 111.756 173.776 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -50.11 -39.41 42.78 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.985 1.314 . . . . 0.0 114.378 -171.579 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.78 -1.47 54.33 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.401 ' O ' ' HG3' ' B' ' 26' ' ' ARG . 27.3 m-70 -115.72 14.19 16.35 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.881 0.873 . . . . 0.0 111.236 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 28.9 mm -103.42 150.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 126.11 1.764 . . . . 0.0 109.541 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.435 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 5.6 tt -89.44 -79.47 0.33 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.41 ' O ' HD23 ' A' ' 47' ' ' LEU . 13.3 t70 -80.66 126.63 77.71 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -80.45 -13.7 12.07 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.755 2.304 . . . . 0.0 114.247 -175.553 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -15.11 62.74 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.387 0.675 . . . . 0.0 112.74 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.419 HD11 HG13 ' A' ' 7' ' ' VAL . 3.9 mm? -58.42 -53.27 60.19 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 118.335 0.516 . . . . 0.0 111.715 178.573 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.14 -32.53 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.876 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.497 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmt -62.4 -52.34 63.97 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 175.452 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.25 72.24 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.494 1.118 . . . . 0.0 111.58 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -62.82 -47.37 83.71 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.206 1.003 . . . . 0.0 110.928 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.34 -9.9 59.29 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 49' ' ' MET . 27.3 mm-40 . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 120.942 0.401 . . . . 0.0 110.447 169.938 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.0 mptt . . . . . 0 C--O 1.238 0.476 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -130.15 127.4 39.67 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.076 0.951 . . . . 0.0 108.824 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.91 -174.0 2.36 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 26' ' ' ARG . . . . . 0.435 ' HG2' ' HB2' ' A' ' 43' ' ' LEU . 9.7 ptp180 . . . . . 0 N--CA 1.47 0.558 0 C-N-CA 123.47 0.708 . . . . 0.0 109.837 -176.162 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 . . . . . 0 CA--C 1.541 0.611 0 CA-C-O 121.133 0.492 . . . . 0.0 109.686 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 t -109.68 144.32 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 124.273 1.029 . . . . 0.0 108.612 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.548 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 72.8 m-85 -128.97 160.73 31.77 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 167.201 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.48 114.13 10.27 Favored 'General case' 0 C--O 1.242 0.673 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 166.284 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.414 HG12 ' O ' ' B' ' 23' ' ' LYS . 3.1 p -92.95 137.88 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.083 0.553 . . . . 0.0 111.331 -172.054 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.653 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.8 tt0 -63.12 -59.56 4.61 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.714 0.806 . . . . 0.0 109.496 174.487 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.3 p -176.73 176.53 1.5 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-N 113.621 -1.627 . . . . 0.0 108.844 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.522 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.4 mm -82.95 115.6 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -53.56 18.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.184 0.594 . . . . 0.0 110.279 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -133.96 166.32 22.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.565 0.746 . . . . 0.0 110.566 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -151.06 142.2 23.15 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -154.42 173.23 16.52 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.447 0.699 . . . . 0.0 109.318 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.03 125.03 9.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.966 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.3 ptt180 -139.9 122.22 15.99 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.651 0.78 . . . . 0.0 109.296 178.489 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 62.62 26.45 15.68 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.853 1.261 . . . . 0.0 110.667 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.46 -8.01 80.49 Favored Glycine 0 C--N 1.354 1.543 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.712 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 70.2 mmtt -89.77 112.96 24.42 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 117.252 0.526 . . . . 0.0 110.858 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.2 t -89.36 108.33 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.37 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -96.76 155.73 16.65 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.243 0.617 . . . . 0.0 110.738 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.522 ' HB3' HD12 ' A' ' 10' ' ' ILE . 66.2 m-85 -132.99 112.22 11.66 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.142 0.977 . . . . 0.0 108.693 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.26 90.58 0.5 Allowed 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.617 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.26 106.91 4.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.521 0.728 . . . . 0.0 111.305 -173.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -82.8 107.25 15.29 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 52.9 m95 -71.45 149.25 46.06 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.853 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.653 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 26.7 ttpp -67.48 -65.43 0.69 Allowed 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.319 0.648 . . . . 0.0 112.614 -166.102 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.21 41.07 2.72 Favored Glycine 0 N--CA 1.467 0.763 0 CA-C-N 116.583 -0.28 . . . . 0.0 112.759 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.512 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.7 m95 -139.57 133.97 16.03 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 123.715 0.806 . . . . 0.0 109.385 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -59.71 157.31 33.22 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 122.775 2.317 . . . . 0.0 112.374 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.55 -15.23 19.32 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 124.046 3.164 . . . . 0.0 115.328 -172.754 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.52 -25.19 67.88 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -87.39 -5.1 59.0 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.463 0.705 . . . . 0.0 112.619 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.1 p -66.6 125.83 27.0 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 21.4 p -118.36 135.91 54.05 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.692 0.797 . . . . 0.0 110.904 -173.239 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -68.81 85.4 0.32 Allowed 'General case' 0 C--N 1.356 0.874 0 C-N-CA 123.276 0.63 . . . . 0.0 109.389 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -100.64 102.83 20.63 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.059 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -62.91 178.92 0.86 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 122.513 2.142 . . . . 0.0 113.234 173.8 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -59.13 -24.19 62.79 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.8 mp0 -73.84 -23.18 59.6 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.175 0.59 . . . . 0.0 111.979 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -94.56 -19.27 20.65 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -168.241 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.46 HG23 ' HA ' ' B' ' 25' ' ' ALA . 33.2 mm -90.81 149.36 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.76 0.824 . . . . 0.0 110.613 -174.17 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -86.34 -71.94 0.52 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.214 0.606 . . . . 0.0 109.617 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -72.03 126.68 91.2 Favored Pre-proline 0 CA--C 1.562 1.407 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -76.43 -23.23 11.71 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.575 2.183 . . . . 0.0 113.796 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.405 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 88.8 mtm180 -69.87 -12.83 61.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.33 1.052 . . . . 0.0 113.59 -168.95 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.438 ' HB3' HG12 ' A' ' 10' ' ' ILE . 3.0 mm? -57.31 -40.63 78.26 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 118.116 0.416 . . . . 0.0 110.693 171.525 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.63 -43.95 93.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.059 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.426 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 1.5 mpt? -61.95 -50.58 71.56 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.589 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.32 -34.97 74.55 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.283 1.033 . . . . 0.0 111.797 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.34 -39.69 94.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.039 0.936 . . . . 0.0 110.926 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -87.15 -10.68 52.1 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.735 0.814 . . . . 0.0 111.942 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' MET . 41.0 mm-40 . . . . . 0 N--CA 1.482 1.17 0 C-N-CA 122.856 0.463 . . . . 0.0 110.785 175.025 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 23' ' ' LYS . . . . . 0.414 ' O ' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.97 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 . . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -102.03 104.3 14.95 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.164 0.506 . . . . 0.0 110.647 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.46 ' HA ' HG23 ' A' ' 42' ' ' ILE . . . -103.85 142.34 34.57 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 164.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 . . . . . 0 N--CA 1.469 0.505 0 C-N-CA 123.104 0.561 . . . . 0.0 110.092 -172.537 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 121.219 0.533 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 46.0 t -83.65 125.01 40.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.482 1.113 . . . . 0.0 109.512 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.401 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 68.8 m-85 -133.44 147.01 51.68 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.937 0.495 . . . . 0.0 110.421 176.952 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.66 111.32 4.73 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.1 p -89.37 144.14 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.685 0.794 . . . . 0.0 110.736 -176.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -81.92 -61.19 1.99 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.739 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.6 m -158.35 171.58 19.91 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.937 0.895 . . . . 0.0 110.221 -174.7 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.468 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 34.7 mm -92.81 117.5 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 163.534 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.01 -46.91 27.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.944 0.898 . . . . 0.0 109.887 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -151.65 166.1 32.3 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.532 0.733 . . . . 0.0 109.765 -176.61 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -146.97 152.21 38.26 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.242 1.017 . . . . 0.0 109.68 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -165.15 167.69 17.91 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.367 1.467 . . . . 0.0 108.526 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 13.6 p -118.42 145.35 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 172.898 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -142.81 96.02 2.87 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.178 0.591 . . . . 0.0 109.602 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm 55.96 39.19 30.58 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.546 1.138 . . . . 0.0 111.554 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.48 -19.51 52.2 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.752 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -85.75 108.29 18.01 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.661 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 11.3 t -85.9 109.77 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -175.29 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -93.82 136.53 34.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.896 0.878 . . . . 0.0 109.657 -170.38 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -124.48 122.79 38.61 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -71.63 85.87 0.89 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 170.009 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.614 HG21 HD11 ' A' ' 42' ' ' ILE . 65.8 t -77.43 107.03 8.35 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.741 -173.069 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -74.54 102.84 4.65 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.233 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.604 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.7 m95 -74.18 138.0 43.49 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.498 177.132 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -77.95 -17.9 56.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.008 0.523 . . . . 0.0 111.35 -172.223 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.37 13.76 28.08 Favored Glycine 0 C--N 1.346 1.116 0 C-N-CA 123.107 0.384 . . . . 0.0 112.994 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.604 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.2 m95 -130.88 147.16 65.14 Favored Pre-proline 0 N--CA 1.482 1.173 0 C-N-CA 123.592 0.757 . . . . 0.0 110.537 178.145 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -55.13 157.26 14.12 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.212 2.608 . . . . 0.0 113.254 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -63.92 -16.74 56.6 Favored 'Trans proline' 0 C--N 1.384 2.409 0 C-N-CA 123.122 2.548 . . . . 0.0 113.338 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.67 -27.94 30.98 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.009 0.524 . . . . 0.0 111.465 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -86.76 -1.43 57.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.628 0.771 . . . . 0.0 111.174 175.557 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.6 m -67.11 117.99 9.91 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 170.362 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.0 p -106.58 151.66 24.73 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.361 0.664 . . . . 0.0 111.269 -172.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -79.19 89.28 4.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.281 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -100.45 119.1 59.76 Favored Pre-proline 0 C--O 1.239 0.53 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.47 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -69.46 171.23 14.5 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.296 1.998 . . . . 0.0 112.073 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -61.9 -19.45 62.68 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.654 0.782 . . . . 0.0 112.13 177.986 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -56.88 -46.59 81.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.993 0.917 . . . . 0.0 110.224 168.997 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.8 m170 -85.47 -25.23 27.03 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.666 -172.835 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.614 HD11 HG21 ' A' ' 24' ' ' VAL . 48.1 mm -81.84 146.21 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.599 0.76 . . . . 0.0 111.624 -174.69 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.1 mt -86.47 -61.92 1.63 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.678 0.791 . . . . 0.0 110.098 173.029 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -72.55 112.68 15.93 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 123.397 0.679 . . . . 0.0 110.161 -172.592 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.49 -24.49 7.59 Favored 'Trans proline' 0 C--N 1.374 1.873 0 C-N-CA 122.582 2.188 . . . . 0.0 112.582 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -72.89 -21.15 60.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.271 1.028 . . . . 0.0 109.71 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 44.5 tp -55.22 -48.64 73.6 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.354 1.461 . . . . 0.0 112.234 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t -68.92 -36.03 72.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.216 -177.505 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.402 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 92.6 mmm -55.86 -45.51 78.48 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.086 0.866 . . . . 0.0 110.666 178.556 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.58 -33.43 63.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.964 0.905 . . . . 0.0 112.454 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.468 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 86.1 t80 -75.44 -46.03 35.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.113 0.965 . . . . 0.0 110.389 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.53 -11.89 61.1 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.652 0.781 . . . . 0.0 112.899 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 49' ' ' MET . 11.0 mm-40 . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 121.323 0.582 . . . . 0.0 109.821 172.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtpt . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -119.91 113.09 20.03 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 122.897 0.479 . . . . 0.0 110.232 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.463 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -96.4 172.66 7.8 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 169.486 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 . . . . . 0 N--CA 1.467 0.386 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 -175.426 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 28.1 mp0 . . . . . 0 CA--C 1.551 1.018 0 CA-C-O 121.112 0.482 . . . . 0.0 112.174 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.9 t -102.15 121.36 53.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 125.022 1.329 . . . . 0.0 107.978 172.631 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.427 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 52.4 m-85 -127.13 155.09 43.89 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 118.065 0.393 . . . . 0.0 110.338 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.97 114.75 6.78 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.82 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.464 HG13 HD11 ' A' ' 47' ' ' LEU . 4.1 p -103.97 137.52 32.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 C-N-CA 124.116 0.967 . . . . 0.0 111.073 -173.053 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -74.87 -63.03 1.35 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.924 -177.554 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -165.48 -177.65 4.54 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.941 0.896 . . . . 0.0 110.385 -173.037 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.55 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.9 mm -86.95 109.68 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 169.301 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.628 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -68.76 -49.62 57.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.848 1.259 . . . . 0.0 109.408 -178.316 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -146.03 168.96 19.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.407 1.083 . . . . 0.0 109.788 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -155.18 138.73 15.97 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.969 0.908 . . . . 0.0 108.897 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -165.56 139.78 4.7 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.64 0.776 . . . . 0.0 109.714 174.532 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.97 118.63 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 CA-C-O 121.256 0.55 . . . . 0.0 110.625 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -107.53 101.3 10.64 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.022 0.929 . . . . 0.0 109.615 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 59.45 40.96 20.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.065 1.346 . . . . 0.0 112.642 174.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.81 -17.64 57.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-N 115.533 -0.758 . . . . 0.0 113.232 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -90.49 110.92 22.03 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.3 t -81.82 111.4 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -93.78 137.94 32.5 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 123.913 0.885 . . . . 0.0 109.474 -173.148 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.55 ' HB3' HD12 ' A' ' 10' ' ' ILE . 72.6 m-85 -121.61 114.73 21.59 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.54 HD23 ' HD2' ' A' ' 11' ' ' ARG . 23.6 tp -70.55 93.62 0.92 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 170.273 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 73.5 t -70.73 105.84 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 124.659 1.184 . . . . 0.0 110.571 -175.882 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 21.0 tptm -78.63 101.06 7.27 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 172.891 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.504 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 74.1 m95 -69.09 141.23 54.78 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 173.753 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -76.65 -39.56 51.86 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.95 -47.96 35.89 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.212 178.339 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.504 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.9 m95 -87.24 136.31 33.76 Favored Pre-proline 0 N--CA 1.479 0.994 0 C-N-CA 123.455 0.702 . . . . 0.0 110.491 -177.987 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -60.42 164.05 13.83 Favored 'Trans proline' 0 CA--C 1.569 2.262 0 C-N-CA 123.081 2.521 . . . . 0.0 112.034 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.53 -19.33 13.41 Favored 'Trans proline' 0 C--N 1.39 2.744 0 C-N-CA 124.059 3.173 . . . . 0.0 115.562 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -71.58 -27.51 63.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.634 0.374 . . . . 0.0 111.991 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.424 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 67.6 m-85 -97.19 12.39 33.0 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.425 0.69 . . . . 0.0 111.857 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -64.77 122.77 17.67 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 173.841 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.7 p -101.55 128.8 47.63 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.877 0.871 . . . . 0.0 111.005 -173.716 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -68.8 83.49 0.3 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 171.811 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 41' ' ' HIS . 29.0 mm-40 -106.85 116.82 58.07 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.994 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.1 174.96 5.23 Favored 'Trans proline' 0 C--N 1.362 1.243 0 C-N-CA 122.064 1.843 . . . . 0.0 111.421 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -56.84 -19.07 15.44 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.495 1.118 . . . . 0.0 112.858 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.73 -22.89 62.68 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.127 1.371 . . . . 0.0 112.078 173.608 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' HIS . . . . . 0.498 ' HB2' ' HB3' ' A' ' 37' ' ' GLU . 74.7 m80 -117.04 -16.47 10.48 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.149 0.98 . . . . 0.0 112.176 -174.094 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mm -82.26 140.92 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 122.905 0.482 . . . . 0.0 110.626 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.5 mt -87.91 -70.73 0.61 Allowed 'General case' 0 C--N 1.351 0.655 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.74 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -72.73 126.63 90.59 Favored Pre-proline 0 CA--C 1.557 1.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -80.13 -17.6 10.45 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.865 2.377 . . . . 0.0 113.828 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.643 ' HA ' ' HG2' ' A' ' 49' ' ' MET . 87.1 mtm180 -69.82 -16.38 63.26 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.247 0.619 . . . . 0.0 111.887 -173.866 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.464 HD11 HG13 ' A' ' 7' ' ' VAL . 4.3 mm? -58.02 -53.75 54.68 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.346 0.658 . . . . 0.0 110.457 172.263 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.7 t -70.69 -53.06 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 114.515 -1.221 . . . . 0.0 109.85 -171.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.643 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 25.6 ptm -59.18 -33.34 70.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.722 0.639 . . . . 0.0 112.086 -174.998 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.97 -49.56 74.24 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -66.13 -30.95 71.54 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.004 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -74.97 -18.88 60.31 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.788 0.835 . . . . 0.0 111.586 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 . . . . . 0 N--CA 1.476 0.826 0 C-N-CA 122.94 0.496 . . . . 0.0 111.544 173.666 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.243 0.76 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -127.55 123.8 36.68 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 111.297 -176.757 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.92 168.42 10.31 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 167.245 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 . . . . . 0 C--N 1.319 -0.754 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -176.007 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 47.9 t -133.85 128.24 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 167.785 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.418 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 63.6 m-85 -138.07 166.8 23.21 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.224 0.61 . . . . 0.0 109.84 175.142 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.92 151.38 44.76 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.42 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.485 HG13 HD11 ' A' ' 47' ' ' LEU . 2.5 p -138.49 133.41 42.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 C-N-CA 124.097 0.959 . . . . 0.0 109.479 -176.898 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -72.64 -50.5 24.77 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.91 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 p -174.25 175.36 2.68 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 124.336 1.054 . . . . 0.0 110.047 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.592 HD12 ' HB3' ' A' ' 22' ' ' TYR . 40.2 mm -78.67 116.9 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 168.226 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -64.61 -56.24 15.14 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 124.306 1.042 . . . . 0.0 109.179 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -141.26 165.94 26.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.11 0.964 . . . . 0.0 110.195 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -146.62 139.19 25.12 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.652 0.781 . . . . 0.0 109.71 -173.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -157.34 170.9 21.42 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.866 1.266 . . . . 0.0 108.49 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 t -129.16 132.88 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 118.665 0.666 . . . . 0.0 109.627 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.417 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 66.4 ttt180 -144.15 122.89 12.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.546 0.739 . . . . 0.0 109.231 -177.955 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.417 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 93.1 mttt 65.24 26.63 12.25 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.752 1.221 . . . . 0.0 111.76 176.746 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.85 -10.8 72.54 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.866 -176.916 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -98.79 115.12 28.08 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.844 0.858 . . . . 0.0 110.471 -176.008 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.4 112.09 14.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -92.23 143.44 26.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.187 0.995 . . . . 0.0 109.679 -175.434 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.592 ' HB3' HD12 ' A' ' 10' ' ' ILE . 66.8 m-85 -129.96 117.54 20.25 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.0 tp -68.63 89.09 0.36 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 172.243 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.557 HG21 HD11 ' A' ' 42' ' ' ILE . 97.4 t -74.65 107.89 5.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.627 0 C-N-CA 123.594 0.758 . . . . 0.0 110.526 -174.477 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -79.45 100.25 7.59 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.441 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.543 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 80.1 m95 -68.19 127.42 32.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.071 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -64.8 -41.18 96.01 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.985 0.914 . . . . 0.0 112.027 -166.136 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.43 18.81 52.97 Favored Glycine 0 N--CA 1.474 1.231 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.578 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.543 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 87.9 m95 -129.79 140.7 39.43 Favored Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 123.798 0.839 . . . . 0.0 109.861 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.435 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 80.1 Cg_exo -51.91 154.33 10.24 Favored 'Trans proline' 0 C--N 1.382 2.315 0 C-N-CA 123.544 2.829 . . . . 0.0 113.989 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -53.65 -24.19 28.75 Favored 'Trans proline' 0 C--N 1.386 2.514 0 C-N-CA 123.949 3.1 . . . . 0.0 114.841 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.435 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 58.6 pttt -66.42 -28.55 68.7 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 122.675 0.39 . . . . 0.0 111.471 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -88.94 2.38 53.95 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.352 0.661 . . . . 0.0 112.15 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.7 p -67.3 117.32 9.15 Favored 'General case' 0 C--N 1.356 0.883 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.3 p -108.22 136.42 47.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.859 0.864 . . . . 0.0 110.506 -173.907 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -69.89 80.62 0.46 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.413 0.685 . . . . 0.0 110.173 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.503 ' HB2' HD11 ' A' ' 42' ' ' ILE . 15.4 mm-40 -94.67 116.0 65.92 Favored Pre-proline 0 C--O 1.239 0.508 0 C-N-CA 123.63 0.772 . . . . 0.0 109.025 177.417 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -66.0 172.19 8.91 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 121.992 1.795 . . . . 0.0 112.19 172.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -54.13 -28.67 41.3 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.687 1.195 . . . . 0.0 112.355 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -59.66 -34.81 73.32 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.185 1.394 . . . . 0.0 111.709 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -85.05 -31.55 23.35 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.507 -173.763 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.557 HD11 HG21 ' A' ' 24' ' ' VAL . 36.9 mm -86.62 144.49 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 124.061 0.944 . . . . 0.0 111.666 -167.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.07 -72.14 0.38 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.543 0.737 . . . . 0.0 110.513 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.33 117.75 64.31 Favored Pre-proline 0 CA--C 1.557 1.227 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -78.3 -15.91 14.0 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.427 2.085 . . . . 0.0 112.893 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -72.76 -12.45 61.01 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 111.981 -173.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.485 HD11 HG13 ' A' ' 7' ' ' VAL . 3.1 mm? -50.95 -45.06 60.55 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 123.048 0.539 . . . . 0.0 110.885 168.163 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.4 t -61.24 -49.88 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.387 -176.88 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -68.83 -37.24 79.04 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.089 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.53 93.87 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.833 0.853 . . . . 0.0 111.017 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.473 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 18.8 t80 -61.92 -53.29 57.82 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.857 0.863 . . . . 0.0 110.667 174.716 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.8 -36.85 76.03 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.4 -170.674 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.489 1.519 0 CA-C-N 118.097 0.408 . . . . 0.0 111.296 -178.686 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 23' ' ' LYS . . . . . 0.44 ' HB3' HD21 ' A' ' 47' ' ' LEU . 1.3 mptm? . . . . . 0 C--O 1.241 0.619 0 CA-C-O 121.369 0.604 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.37 112.81 22.03 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.138 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.542 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.41 168.67 10.25 Favored 'General case' 0 C--O 1.245 0.841 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 169.655 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 122.92 0.488 . . . . 0.0 110.101 -169.525 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.82 0.343 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.8 t -103.05 127.71 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.348 1.059 . . . . 0.0 108.729 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.456 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 76.1 m-85 -138.87 158.04 44.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.368 0.667 . . . . 0.0 109.868 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.93 101.11 5.06 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 171.437 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -72.14 139.57 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.186 0.994 . . . . 0.0 110.996 -175.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 28.4 tt0 -73.11 -51.79 16.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.62 0.768 . . . . 0.0 109.907 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.9 p -175.07 -175.84 0.89 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.054 1.341 . . . . 0.0 109.403 175.628 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.503 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 42.9 mm -97.65 117.65 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 169.796 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.5 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.1 tmt_? -74.1 -58.07 3.54 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.5 1.12 . . . . 0.0 109.594 -177.72 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.3 mttm -136.72 178.83 6.77 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.8 0.84 . . . . 0.0 111.011 -176.182 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.443 ' HE3' HG11 ' A' ' 20' ' ' VAL . 86.1 tttt -158.42 147.57 19.17 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.51 1.124 . . . . 0.0 108.917 -175.557 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -164.03 143.81 8.03 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.995 0.918 . . . . 0.0 109.369 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.1 p -88.05 141.65 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.483 ' HE ' ' HA ' ' A' ' 16' ' ' ARG . 2.3 tpm_? -142.31 99.17 3.45 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.843 0.857 . . . . 0.0 108.747 -174.812 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 60.39 29.81 19.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.382 1.073 . . . . 0.0 111.487 -176.773 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.82 -17.35 58.85 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-N 116.264 -0.426 . . . . 0.0 113.417 -175.563 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.49 111.59 22.0 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.266 0.626 . . . . 0.0 110.067 177.889 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.443 HG11 ' HE3' ' A' ' 13' ' ' LYS . 50.6 t -85.44 111.39 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.006 -175.629 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.421 ' HB3' ' HB3' ' A' ' 36' ' ' TRP . 34.5 mm-40 -94.17 140.63 29.52 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.3 1.44 . . . . 0.0 109.411 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -120.12 120.55 36.55 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.445 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 43.7 tp -68.82 86.86 0.34 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 172.094 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.513 HG21 HD11 ' A' ' 42' ' ' ILE . 88.4 t -73.18 106.08 2.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.187 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -74.54 100.54 3.91 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.69 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.7 m95 -73.24 145.03 46.48 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 3.8 ttmp? -71.24 -39.82 71.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 122.757 0.423 . . . . 0.0 111.836 -173.54 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.78 -10.97 74.94 Favored Glycine 0 C--N 1.346 1.112 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.403 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 23.3 m95 -110.24 141.67 24.37 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.496 0.718 . . . . 0.0 109.468 -176.916 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.73 163.65 36.72 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.414 2.076 . . . . 0.0 111.249 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.75 -26.28 72.58 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.045 2.497 . . . . 0.0 113.704 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.34 -38.71 88.27 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.253 0.621 . . . . 0.0 110.881 176.349 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.435 ' HB3' ' HE3' ' A' ' 29' ' ' TRP . 39.6 m-85 -99.05 0.45 43.75 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.463 0.705 . . . . 0.0 111.917 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.0 m -70.0 129.48 39.57 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.349 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.4 p -109.61 148.94 30.43 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.16 0.584 . . . . 0.0 111.833 -169.74 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' TRP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 87.5 m95 -77.01 86.81 3.52 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.039 0.935 . . . . 0.0 110.402 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.459 ' HB2' HG21 ' A' ' 24' ' ' VAL . 38.8 mm-40 -97.9 118.44 63.89 Favored Pre-proline 0 C--O 1.241 0.647 0 C-N-CA 123.63 0.772 . . . . 0.0 109.305 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.42 ' O ' HG12 ' A' ' 42' ' ' ILE . 73.9 Cg_endo -73.65 177.46 7.99 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.176 1.917 . . . . 0.0 112.117 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.99 -27.2 51.79 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.745 1.218 . . . . 0.0 112.098 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.93 -28.72 69.73 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.918 1.287 . . . . 0.0 111.914 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -99.72 -28.76 13.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.045 0.938 . . . . 0.0 113.124 -172.803 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.513 HD11 HG21 ' A' ' 24' ' ' VAL . 43.8 mm -79.65 145.75 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 C-N-CA 123.948 0.899 . . . . 0.0 112.84 -169.884 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 mt -78.43 -64.34 1.19 Allowed 'General case' 0 C--N 1.358 0.974 0 C-N-CA 123.946 0.898 . . . . 0.0 110.852 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.93 117.46 65.12 Favored Pre-proline 0 N--CA 1.485 1.313 0 CA-C-O 119.412 -0.327 . . . . 0.0 110.628 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.99 -35.3 12.2 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.322 2.682 . . . . 0.0 112.6 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.0 mtm180 -70.45 -16.9 62.98 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.524 -174.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.5 tp -57.64 -44.03 85.33 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.537 1.135 . . . . 0.0 111.342 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.6 t -66.37 -41.94 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.543 0.737 . . . . 0.0 110.337 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.2 mtp -63.06 -30.49 71.64 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.397 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -37.01 85.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.678 0.791 . . . . 0.0 110.869 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.503 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.8 t80 -72.09 -35.04 69.11 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.973 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -64.03 -29.49 70.64 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.572 0.349 . . . . 0.0 110.589 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 N--CA 1.474 0.771 0 C-N-CA 123.34 0.656 . . . . 0.0 111.679 173.747 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 91.7 mttt . . . . . 0 C--O 1.238 0.469 0 CA-C-O 121.055 0.455 . . . . 0.0 111.839 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.53 127.9 54.34 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.161 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -110.78 162.19 15.03 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 169.126 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 . . . . . 0 C--O 1.24 0.556 0 C-N-CA 123.09 0.556 . . . . 0.0 110.025 -172.824 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 . . . . . 0 N--CA 1.476 0.841 0 CA-C-O 121.391 0.615 . . . . 0.0 111.789 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 69.1 t -128.31 129.36 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 125.378 1.471 . . . . 0.0 107.878 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -141.7 162.59 35.11 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.367 0.667 . . . . 0.0 110.569 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.98 131.29 44.84 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.271 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.486 HG13 HD11 ' A' ' 47' ' ' LEU . 2.2 p -123.14 133.89 67.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 124.863 1.265 . . . . 0.0 108.55 -174.267 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -80.46 -40.39 26.32 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.706 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.3 p -175.91 179.46 1.33 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.788 0.835 . . . . 0.0 110.289 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.413 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.9 mm -89.73 122.78 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 165.483 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.531 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -80.89 -51.2 8.83 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.442 0.697 . . . . 0.0 109.371 -178.27 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.446 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 27.2 mtpp -137.11 171.77 14.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.621 0.768 . . . . 0.0 111.104 -175.975 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -155.24 143.25 20.04 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.538 0.735 . . . . 0.0 109.953 -174.016 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -160.91 144.43 13.25 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.701 0.8 . . . . 0.0 109.614 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.61 115.54 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -121.0 119.8 33.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.347 1.059 . . . . 0.0 109.41 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 63.51 25.65 14.52 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.175 0.99 . . . . 0.0 112.146 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.0 -12.78 52.43 Favored Glycine 0 N--CA 1.475 1.244 0 CA-C-N 116.227 -0.442 . . . . 0.0 113.053 -174.463 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.476 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 1.3 mmmp? -83.67 111.64 19.32 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.494 1.118 . . . . 0.0 108.546 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 t -82.09 106.23 12.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -97.3 142.9 28.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.459 1.104 . . . . 0.0 109.61 -174.763 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.413 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.6 m-85 -127.25 126.22 42.32 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.601 0.76 . . . . 0.0 109.693 -176.691 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.475 HD23 ' HB3' ' A' ' 11' ' ' ARG . 50.0 tp -67.7 94.17 0.42 Allowed 'General case' 0 C--N 1.349 0.583 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.343 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.523 HG21 HD11 ' A' ' 42' ' ' ILE . 90.1 t -77.1 104.01 4.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.879 -178.326 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 26.6 tptp -79.97 99.99 7.89 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -177.269 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.6 m95 -67.05 136.43 55.22 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.981 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -58.7 -33.75 70.53 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.037 0.535 . . . . 0.0 111.024 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.54 -55.43 2.71 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.495 176.075 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 98.4 m95 -77.97 129.57 75.55 Favored Pre-proline 0 CA--C 1.563 1.443 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -170.567 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.49 160.13 1.78 Allowed 'Trans proline' 0 C--N 1.387 2.603 0 C-N-CA 124.673 3.582 . . . . 0.0 113.465 172.742 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.463 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 32.1 Cg_endo -60.55 -17.8 50.67 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 123.132 2.554 . . . . 0.0 114.415 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.7 pttt -83.13 -32.65 26.56 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.639 0.376 . . . . 0.0 111.214 174.172 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -87.22 -8.67 56.59 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.108 0.563 . . . . 0.0 110.578 173.994 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 68.0 m -73.44 133.25 43.65 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 171.503 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.8 p -99.44 133.36 43.87 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.558 0.743 . . . . 0.0 111.075 -168.759 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -75.02 83.54 2.26 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.263 0.625 . . . . 0.0 110.106 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB2' HG21 ' A' ' 24' ' ' VAL . 44.4 mm-40 -104.85 130.59 22.91 Favored Pre-proline 0 N--CA 1.468 0.444 0 C-N-CA 123.262 0.625 . . . . 0.0 110.448 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.411 ' O ' HG12 ' A' ' 42' ' ' ILE . 40.0 Cg_endo -64.54 164.46 23.55 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 122.003 1.802 . . . . 0.0 112.037 170.644 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -52.86 -30.51 34.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.46 1.104 . . . . 0.0 111.701 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.9 -34.59 78.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.212 1.405 . . . . 0.0 111.468 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.0 m170 -85.1 -9.94 57.37 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.961 0.904 . . . . 0.0 112.793 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.523 HD11 HG21 ' A' ' 24' ' ' VAL . 38.8 mm -90.48 155.94 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 123.943 0.897 . . . . 0.0 110.959 -176.596 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -84.13 -77.67 0.26 Allowed 'General case' 0 C--N 1.353 0.748 0 C-N-CA 123.128 0.571 . . . . 0.0 109.98 167.656 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -75.14 127.92 85.72 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-O 119.673 -0.203 . . . . 0.0 111.168 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.26 -31.34 22.96 Favored 'Trans proline' 0 C--N 1.375 1.937 0 C-N-CA 122.547 2.164 . . . . 0.0 113.802 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.2 -14.42 37.74 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.66 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.486 HD11 HG13 ' A' ' 7' ' ' VAL . 3.5 mm? -60.3 -50.59 73.03 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 118.749 0.704 . . . . 0.0 110.012 170.143 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 74.1 t -67.51 -54.01 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.882 178.364 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 49' ' ' MET . 0.4 OUTLIER -58.97 -45.48 90.43 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.746 0.819 . . . . 0.0 112.09 -173.369 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.12 87.3 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.281 0.363 . . . . 0.0 111.175 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.45 -37.34 86.6 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.061 0.945 . . . . 0.0 110.747 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 31.0 mm-40 -69.95 -23.13 63.14 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.282 0.633 . . . . 0.0 111.081 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 . . . . . 0 N--CA 1.48 1.055 0 C-N-CA 124.27 1.028 . . . . 0.0 112.227 -179.684 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt . . . . . 0 C--O 1.242 0.66 0 CA-C-O 121.131 0.491 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -112.77 134.06 54.48 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.714 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.463 ' HB2' HG11 ' A' ' 7' ' ' VAL . . . -109.19 -175.69 2.83 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 171.566 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 . . . . . 0 C--O 1.238 0.499 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -170.36 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 . . . . . 0 CA--C 1.541 0.597 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -102.01 136.1 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.012 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -138.58 153.85 48.69 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.895 0.878 . . . . 0.0 109.014 170.823 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.66 134.38 47.49 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 173.734 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -120.63 141.78 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.211 1.005 . . . . 0.0 110.164 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -73.65 -60.27 2.33 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.579 174.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.3 p -170.91 -174.61 1.58 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.425 1.09 . . . . 0.0 109.548 -175.349 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.523 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 50.8 mm -97.87 117.86 43.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.018 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.24 -50.18 35.56 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.048 0.939 . . . . 0.0 110.529 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -140.72 170.8 15.09 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.475 0.71 . . . . 0.0 110.634 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -155.77 148.5 24.1 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.894 0.878 . . . . 0.0 108.635 -175.028 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.468 ' NH1' ' HD2' ' A' ' 16' ' ' ARG . 2.2 ptm180 -159.92 154.67 24.32 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.59 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -104.44 137.4 33.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 166.596 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.468 ' HD2' ' NH1' ' A' ' 14' ' ' ARG . 75.4 ttt180 -150.52 98.6 2.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -168.869 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 65.55 25.42 11.75 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.549 0.74 . . . . 0.0 111.115 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.71 -16.16 59.91 Favored Glycine 0 C--N 1.355 1.595 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.817 -173.892 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -84.24 111.32 19.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.9 t -86.95 108.04 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -97.05 144.43 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.126 0.57 . . . . 0.0 109.605 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.457 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.3 m-85 -123.45 116.82 23.86 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.7 tp -68.09 88.02 0.28 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 170.742 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.85 106.98 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.938 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -76.98 96.97 4.5 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.9 m95 -68.69 145.53 53.78 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -80.62 -30.35 36.75 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.6 -10.65 84.97 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 115.897 -0.592 . . . . 0.0 113.669 177.032 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.3 m95 -131.15 132.36 23.7 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 110.199 -177.208 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.42 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 32.4 Cg_endo -62.94 170.11 7.92 Favored 'Trans proline' 0 CA--C 1.572 2.395 0 C-N-CA 122.853 2.369 . . . . 0.0 112.483 175.168 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.62 -24.2 69.21 Favored 'Trans proline' 0 C--N 1.394 2.947 0 C-N-CA 122.793 2.328 . . . . 0.0 114.016 -174.89 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.86 -28.24 65.5 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.389 0.676 . . . . 0.0 112.512 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.55 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 80.2 m-85 -96.84 -3.59 41.83 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.17 0.588 . . . . 0.0 111.579 175.254 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.3 m -66.79 132.86 48.95 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.677 0.391 . . . . 0.0 109.988 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.1 p -122.79 150.37 42.9 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.651 -169.878 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -80.55 83.17 6.4 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.622 0.769 . . . . 0.0 110.521 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -95.17 121.22 62.75 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.57 165.39 29.45 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 121.853 1.702 . . . . 0.0 111.088 172.591 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -53.8 -27.25 28.12 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.078 0.951 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -60.3 -40.95 92.33 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.796 1.239 . . . . 0.0 110.992 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 17.3 m170 -81.45 -29.76 33.68 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.426 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.92 143.95 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.473 0.709 . . . . 0.0 111.348 -175.033 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.412 ' HB3' ' O ' ' B' ' 24' ' ' ALA . 5.1 tt -82.69 -77.53 0.23 Allowed 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.65 122.42 85.76 Favored Pre-proline 0 CA--C 1.556 1.186 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.496 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.33 -15.54 22.48 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 122.779 2.319 . . . . 0.0 114.107 -175.426 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 50.0 mtm180 -71.02 -12.14 61.36 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.25 -42.11 80.9 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 118.134 0.425 . . . . 0.0 111.127 170.194 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.508 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 48.0 t -62.12 -50.33 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.122 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.402 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 25.2 mmt -57.48 -40.16 77.97 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.129 0.972 . . . . 0.0 111.66 -177.986 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.17 -33.76 76.77 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.054 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.523 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 83.1 t80 -74.83 -37.67 62.23 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.429 0.692 . . . . 0.0 110.485 174.927 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 18.8 mm-40 -67.51 -20.49 65.45 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.792 0.437 . . . . 0.0 110.709 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 49' ' ' MET . 22.3 mm-40 . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 123.699 0.799 . . . . 0.0 112.267 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? . . . . . 0 C--O 1.246 0.896 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 24' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' A' ' 43' ' ' LEU . . . -121.28 125.46 47.11 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -94.6 -179.25 4.82 Favored 'General case' 0 C--O 1.244 0.794 0 N-CA-C 107.921 -1.141 . . . . 0.0 107.921 169.113 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 . . . . . 0 C--O 1.239 0.501 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -169.306 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 121.347 0.594 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.8 t -124.99 122.51 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -133.3 160.97 35.76 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 123.31 0.644 . . . . 0.0 109.967 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.02 136.3 55.06 Favored 'General case' 0 C--O 1.248 1.017 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.045 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 p -116.34 145.27 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.82 0.848 . . . . 0.0 110.178 -174.358 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -78.87 -56.17 4.6 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.803 0.841 . . . . 0.0 109.748 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.0 p -175.19 -171.53 0.52 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.491 1.116 . . . . 0.0 110.2 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.547 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -99.68 117.97 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 170.183 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -52.17 14.08 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.509 1.124 . . . . 0.0 110.221 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -139.72 169.41 17.78 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.418 0.687 . . . . 0.0 111.353 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -155.77 137.67 14.44 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.313 1.045 . . . . 0.0 108.781 -177.15 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -160.94 137.63 8.7 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.98 0.912 . . . . 0.0 108.935 177.883 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.46 129.85 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -136.61 113.76 10.64 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? 62.21 33.41 16.77 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 124.547 1.139 . . . . 0.0 109.459 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.84 -18.94 18.2 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.749 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -84.54 111.01 19.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.51 0.724 . . . . 0.0 109.303 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.9 t -78.59 110.77 14.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -93.98 138.76 31.73 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.61 1.164 . . . . 0.0 109.894 -171.329 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.547 ' HB3' HD12 ' A' ' 10' ' ' ILE . 79.1 m-85 -125.54 116.42 21.74 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.432 0.693 . . . . 0.0 109.434 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.8 tp -69.54 91.52 0.59 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 170.149 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.624 HG21 HD11 ' A' ' 42' ' ' ILE . 73.1 t -73.43 106.18 3.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.174 -175.789 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.534 ' HE2' ' HD3' ' A' ' 31' ' ' PRO . 25.4 tptp -76.2 102.4 5.78 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 174.274 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -73.21 154.68 40.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.087 0.555 . . . . 0.0 110.894 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -75.75 -44.28 42.54 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 171.159 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.48 -41.42 30.12 Favored Glycine 0 C--N 1.352 1.462 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.194 -178.168 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -100.91 143.19 26.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.231 0.612 . . . . 0.0 111.166 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.37 172.86 14.11 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 123.5 2.8 . . . . 0.0 112.415 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' PRO . . . . . 0.534 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 30.0 Cg_endo -61.21 -29.23 86.25 Favored 'Trans proline' 0 C--N 1.394 2.921 0 C-N-CA 122.963 2.442 . . . . 0.0 113.401 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -67.5 -30.05 69.63 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.296 0.638 . . . . 0.0 111.401 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 13.88 29.27 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.629 0.771 . . . . 0.0 111.614 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.9 m -74.43 136.03 42.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 169.637 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.8 p -114.84 138.16 51.1 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.492 0.717 . . . . 0.0 112.046 -168.44 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -74.88 87.76 2.29 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.542 0.737 . . . . 0.0 109.899 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HB2' HD11 ' A' ' 42' ' ' ILE . 42.9 mm-40 -108.87 116.61 55.48 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 123.894 0.878 . . . . 0.0 109.905 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 37' ' ' GLU . 38.4 Cg_endo -63.25 169.15 9.83 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 122.551 2.167 . . . . 0.0 112.699 169.795 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -34.81 48.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.306 1.442 . . . . 0.0 113.244 -178.454 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -67.72 -34.37 76.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.893 0.877 . . . . 0.0 110.867 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -78.78 -17.8 55.19 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.625 0.77 . . . . 0.0 111.455 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.624 HD11 HG21 ' A' ' 24' ' ' VAL . 48.9 mm -98.5 148.78 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 124.359 1.064 . . . . 0.0 110.749 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.7 mt -82.1 -70.62 0.53 Allowed 'General case' 0 C--N 1.352 0.675 0 C-N-CA 123.49 0.716 . . . . 0.0 109.919 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -77.01 132.74 70.36 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.902 -171.759 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.435 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 98.1 Cg_endo -78.48 -30.44 3.2 Favored 'Trans proline' 0 CA--C 1.562 1.913 0 C-N-CA 122.52 2.147 . . . . 0.0 115.0 -176.918 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.435 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.32 0.0 OUTLIER -72.61 -9.7 58.91 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.031 . . . . . . . . 4 4 . 1 . 009 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -53.18 -47.91 68.44 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 119.117 0.871 . . . . 0.0 109.911 166.371 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.422 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 63.0 t -60.87 -45.65 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.248 177.463 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.477 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 53.4 mtt -64.09 -30.1 71.19 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.649 0.78 . . . . 0.0 111.305 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.44 78.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 0.0 110.115 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -75.45 -35.12 60.96 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.743 174.389 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.7 mm-40 -69.76 -32.66 71.3 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.583 0.353 . . . . 0.0 111.063 -177.151 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 49' ' ' MET . 22.0 mm-40 . . . . . 0 N--CA 1.477 0.9 0 C-N-CA 123.344 0.658 . . . . 0.0 111.179 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt . . . . . 0 C--O 1.251 1.166 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -110.08 109.21 19.67 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.996 176.815 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.428 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.21 172.15 7.99 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 167.056 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.7 ttp180 . . . . . 0 CA--C 1.541 0.602 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.516 -165.282 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 120.988 0.423 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.9 t -91.83 132.56 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -131.93 163.0 29.31 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 171.865 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' ALA . . . . . 0.423 ' HB3' ' HE3' ' A' ' 27' ' ' LYS . . . -85.57 116.34 23.81 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.151 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.56 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -98.46 141.17 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.693 1.197 . . . . 0.0 109.28 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 9.7 tp10 -80.26 -49.53 11.47 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.468 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.0 p -171.38 171.79 5.41 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.142 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 49.5 mm -88.27 113.76 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.411 -0.813 . . . . 0.0 108.865 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.405 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.4 tmt_? -72.06 -53.07 13.98 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.546 0.738 . . . . 0.0 109.415 -178.442 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.455 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 65.6 mttm -137.82 173.89 11.16 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.316 0.646 . . . . 0.0 111.249 -176.717 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -157.5 150.38 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.974 0.91 . . . . 0.0 109.322 -174.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.9 ptt85 -168.23 178.75 4.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.622 1.169 . . . . 0.0 109.029 173.299 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.43 132.94 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.871 0.868 . . . . 0.0 108.747 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -142.64 111.76 6.52 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 59.91 42.61 16.02 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.575 1.15 . . . . 0.0 112.383 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.89 -17.32 32.24 Favored Glycine 0 N--CA 1.471 0.985 0 CA-C-N 115.8 -0.636 . . . . 0.0 113.516 176.63 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -84.73 109.91 18.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.1 t -83.92 104.13 11.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 171.006 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.458 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 1.0 OUTLIER -103.28 144.74 30.95 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.824 0.821 . . . . 0.0 110.9 -175.758 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -119.11 124.13 46.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.355 -173.235 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.455 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 55.1 tp -65.57 89.27 0.1 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 170.503 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.456 HG21 ' HB2' ' A' ' 37' ' ' GLU . 74.1 t -76.01 105.57 5.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.173 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -83.99 99.95 10.74 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 53.0 m95 -66.83 134.58 52.4 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -70.42 -15.96 62.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.479 0.312 . . . . 0.0 111.651 -177.694 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.09 10.11 22.74 Favored Glycine 0 C--N 1.351 1.373 0 CA-C-O 119.666 -0.519 . . . . 0.0 113.664 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 81.0 m95 -134.91 148.17 65.86 Favored Pre-proline 0 N--CA 1.498 1.965 0 CA-C-N 117.748 0.774 . . . . 0.0 110.158 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -74.53 165.27 32.05 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.911 2.407 . . . . 0.0 112.062 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.55 -33.87 49.87 Favored 'Trans proline' 0 C--N 1.391 2.775 0 C-N-CA 124.084 3.189 . . . . 0.0 114.646 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -69.43 -30.21 68.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.061 0.544 . . . . 0.0 112.357 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -95.05 -8.41 36.77 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.609 0.764 . . . . 0.0 111.441 175.083 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 59.4 m -75.35 112.23 11.44 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.732 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.4 p -98.36 147.79 24.33 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.64 0.776 . . . . 0.0 111.795 -169.601 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -75.12 89.02 2.46 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.441 0.696 . . . . 0.0 110.226 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.456 ' HB2' HG21 ' A' ' 24' ' ' VAL . 45.8 mm-40 -97.89 119.5 62.16 Favored Pre-proline 0 N--CA 1.469 0.507 0 C-N-CA 123.461 0.704 . . . . 0.0 109.872 178.287 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 47.4 Cg_endo -66.31 167.49 18.38 Favored 'Trans proline' 0 C--N 1.369 1.636 0 C-N-CA 122.07 1.846 . . . . 0.0 112.001 172.605 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.07 -27.0 61.33 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.416 1.087 . . . . 0.0 112.262 176.792 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.42 -35.33 65.28 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 125.176 1.39 . . . . 0.0 111.717 171.907 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 16.6 m170 -93.44 -18.15 22.66 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.075 0.95 . . . . 0.0 112.559 -173.92 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.1 mm -86.54 151.57 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.061 0.944 . . . . 0.0 111.352 -171.793 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -96.73 -69.15 0.77 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.749 0.82 . . . . 0.0 110.823 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.15 117.34 53.38 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.42 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 72.0 Cg_endo -74.37 -17.83 20.93 Favored 'Trans proline' 0 C--N 1.369 1.646 0 C-N-CA 122.722 2.281 . . . . 0.0 113.185 -175.939 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.42 ' HD3' ' HG2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -72.22 -12.22 61.07 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.502 0.721 . . . . 0.0 112.481 -177.652 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.405 HD11 HG13 ' A' ' 7' ' ' VAL . 2.2 mm? -52.13 -51.06 60.22 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 118.512 0.597 . . . . 0.0 110.59 169.479 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 59.3 t -61.04 -48.4 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 124.107 0.879 . . . . 0.0 109.694 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.2 mmt -60.44 -38.49 84.31 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.998 -175.118 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.84 -36.41 83.39 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.754 0.821 . . . . 0.0 110.571 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.545 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 81.5 t80 -69.8 -42.72 73.36 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.723 0.809 . . . . 0.0 110.424 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.3 mm-40 -60.69 -37.88 83.14 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.263 0.625 . . . . 0.0 111.285 -177.288 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 . . . . . 0 N--CA 1.476 0.834 0 C-N-CA 123.884 0.873 . . . . 0.0 112.218 -179.482 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 71.8 mttt . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -107.06 106.64 17.25 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.097 0.475 . . . . 0.0 110.761 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -106.75 151.05 25.66 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 162.254 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--N 1.316 -0.875 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -175.098 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 . . . . . 0 CA--C 1.542 0.648 0 CA-C-O 120.63 0.253 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 91.4 t -103.24 116.19 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.565 0.746 . . . . 0.0 109.108 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -130.34 167.03 19.18 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 123.718 0.807 . . . . 0.0 109.402 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.13 122.06 19.44 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.035 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.2 p -97.97 135.94 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.356 0.662 . . . . 0.0 110.177 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -68.19 -52.72 31.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.951 0.901 . . . . 0.0 110.007 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.2 p -177.72 178.0 1.05 Allowed 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.714 -176.831 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.464 HD12 ' HB3' ' A' ' 22' ' ' TYR . 47.9 mm -89.95 114.99 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 168.956 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.558 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -69.82 -51.4 33.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.643 0.777 . . . . 0.0 109.05 -179.393 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -139.26 161.82 36.49 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.301 0.641 . . . . 0.0 111.348 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' LYS . . . . . 0.528 ' HE3' HG11 ' A' ' 20' ' ' VAL . 83.1 tttt -147.69 133.35 18.85 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 108.064 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -159.29 139.39 11.97 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 123.476 0.71 . . . . 0.0 109.396 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.469 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 5.0 p -87.22 121.41 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -134.46 123.49 24.07 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.74 0.816 . . . . 0.0 109.045 -176.558 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 64.24 28.02 13.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.324 1.05 . . . . 0.0 111.854 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.83 -16.97 53.31 Favored Glycine 0 C--N 1.351 1.406 0 CA-C-N 115.484 -0.78 . . . . 0.0 113.258 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -105.46 134.3 48.8 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.82 0.848 . . . . 0.0 110.443 -176.631 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.528 HG11 ' HE3' ' A' ' 13' ' ' LYS . 21.7 t -83.2 116.36 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -174.527 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -95.36 142.03 28.23 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 124.895 1.278 . . . . 0.0 109.741 -178.066 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.464 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.1 m-85 -125.0 120.44 31.56 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.49 0.716 . . . . 0.0 109.75 -178.706 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.512 HD23 ' HD2' ' A' ' 11' ' ' ARG . 27.7 tp -75.22 82.32 2.37 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 169.787 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.469 HG21 HD11 ' A' ' 42' ' ' ILE . 67.1 t -68.65 106.49 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.421 -175.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.3 tptp -84.53 102.82 13.15 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.552 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.597 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.8 m95 -71.5 147.05 48.14 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.247 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -78.44 -36.14 45.87 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.157 0.583 . . . . 0.0 109.903 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.43 -14.45 82.16 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.775 178.595 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.597 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.4 m95 -120.3 148.92 48.51 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 123.253 0.621 . . . . 0.0 111.381 -175.65 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 169.97 20.62 Favored 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.22 2.613 . . . . 0.0 112.2 175.104 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -55.52 -26.43 54.45 Favored 'Trans proline' 0 C--N 1.393 2.893 0 C-N-CA 123.715 2.943 . . . . 0.0 114.999 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -70.41 -9.23 55.8 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.423 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 69.5 m-85 -118.02 14.25 14.06 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.869 0.867 . . . . 0.0 111.409 175.398 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -70.07 116.8 10.86 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.0 p -105.36 137.19 43.56 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.297 0.639 . . . . 0.0 111.878 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -73.87 83.43 1.68 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.111 0.564 . . . . 0.0 109.933 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -110.62 113.14 55.96 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 123.892 0.877 . . . . 0.0 108.863 176.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.429 ' HA ' ' HD2' ' A' ' 22' ' ' TYR . 61.9 Cg_endo -66.8 166.84 21.1 Favored 'Trans proline' 0 C--N 1.365 1.424 0 C-N-CA 122.238 1.959 . . . . 0.0 111.782 173.833 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.21 -23.87 50.75 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.582 1.153 . . . . 0.0 112.807 -177.827 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -62.46 -27.25 68.99 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.106 1.362 . . . . 0.0 111.655 178.246 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -113.01 2.84 15.9 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.398 1.079 . . . . 0.0 112.408 -173.243 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.568 HD12 ' HB1' ' B' ' 25' ' ' ALA . 48.8 mm -101.16 148.55 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 124.58 1.152 . . . . 0.0 110.793 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.629 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 53.5 mt -75.68 -78.93 0.1 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 122.989 0.515 . . . . 0.0 110.811 172.458 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -75.05 112.85 19.92 Favored Pre-proline 0 N--CA 1.48 1.07 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -174.0 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -78.21 -13.65 15.29 Favored 'Trans proline' 0 C--N 1.371 1.752 0 C-N-CA 122.872 2.382 . . . . 0.0 112.945 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.56 -12.38 61.34 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.469 0.708 . . . . 0.0 111.41 179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.591 HD22 ' NZ ' ' B' ' 23' ' ' LYS . 3.1 mm? -51.05 -39.16 55.31 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.478 0.311 . . . . 0.0 110.87 167.521 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.5 -51.48 46.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 123.861 0.864 . . . . 0.0 110.882 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 28.3 ptm -64.08 -35.08 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.0 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.11 -34.03 76.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.672 0.789 . . . . 0.0 111.315 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.443 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 74.3 t80 -70.14 -35.36 74.01 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.458 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -85.14 -7.44 59.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.5 0.72 . . . . 0.0 111.965 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 49' ' ' MET . 43.8 mm-40 . . . . . 0 N--CA 1.473 0.677 0 C-N-CA 122.71 0.404 . . . . 0.0 109.978 166.67 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 23' ' ' LYS . . . . . 0.591 ' NZ ' HD22 ' A' ' 47' ' ' LEU . 6.8 mtpm? . . . . . 0 C--O 1.241 0.635 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 . . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -117.96 137.93 52.51 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.107 0.479 . . . . 0.0 111.041 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.568 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -102.9 -167.65 1.42 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.41 171.975 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' B' B ' 26' ' ' ARG . . . . . 0.629 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 75.9 ttt180 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -172.582 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 110.778 -0.082 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.403 HG22 ' HD3' ' B' ' 26' ' ' ARG . 20.0 t -88.3 127.19 41.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.464 0.706 . . . . 0.0 109.635 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.427 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 87.7 m-85 -140.58 152.76 45.74 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.291 0.636 . . . . 0.0 110.113 172.659 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.28 117.37 11.75 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 170.074 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -91.39 134.19 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 110.104 -177.625 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.533 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 43.8 tt0 -68.04 -43.68 78.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.424 0.69 . . . . 0.0 110.505 178.232 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 p 177.94 169.51 0.72 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.386 1.074 . . . . 0.0 110.399 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -82.19 113.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.267 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.496 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -73.02 -58.12 3.54 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -177.378 . . . . . . . . 3 3 . 1 . 012 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.422 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 98.3 mttt -134.31 174.29 10.68 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.723 0.809 . . . . 0.0 109.789 -178.547 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -159.85 141.59 12.95 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 123.756 0.822 . . . . 0.0 109.075 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -154.12 159.46 41.48 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.521 0.728 . . . . 0.0 109.755 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 20' ' ' VAL . 40.8 t -104.13 130.25 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 168.779 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -146.73 111.53 5.31 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.3 tptt 65.43 26.35 11.91 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.809 1.243 . . . . 0.0 110.324 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.83 -9.21 46.0 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-N 115.228 -0.896 . . . . 0.0 113.156 -174.279 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.06 110.55 20.71 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 15' ' ' VAL . 47.9 t -84.1 107.07 15.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -174.437 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -98.49 141.42 31.37 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.784 0.834 . . . . 0.0 110.477 -173.022 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.48 ' HB3' HG23 ' A' ' 10' ' ' ILE . 8.6 m-85 -114.23 125.01 53.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.422 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 31.9 tp -70.86 85.17 0.67 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 169.669 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.408 HG21 ' HB2' ' A' ' 37' ' ' GLU . 95.3 t -72.78 104.13 1.92 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.454 -173.215 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.8 tptp -84.0 100.34 11.0 Favored 'General case' 0 C--N 1.345 0.388 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.547 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.1 m95 -69.35 151.03 46.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.623 -179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.533 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 35.7 ttpt -67.88 -46.11 72.6 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 122.981 0.512 . . . . 0.0 111.419 -173.795 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.87 -6.15 72.81 Favored Glycine 0 C--N 1.35 1.34 0 CA-C-N 115.878 -0.601 . . . . 0.0 113.868 -176.877 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.547 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 56.3 m95 -114.85 129.49 24.97 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.404 0.682 . . . . 0.0 110.148 -175.124 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -61.57 165.35 13.64 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.155 2.57 . . . . 0.0 112.35 171.925 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -64.41 -8.95 18.38 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.378 2.718 . . . . 0.0 114.709 -175.506 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -26.84 61.0 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.464 0.306 . . . . 0.0 110.998 173.531 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -99.45 -12.41 20.24 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.813 0.845 . . . . 0.0 111.52 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.7 p -64.65 119.8 11.21 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.7 p -107.06 150.27 26.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.787 0.835 . . . . 0.0 111.113 -172.333 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -76.41 86.63 3.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.46 0.704 . . . . 0.0 110.194 178.017 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.408 ' HB2' HG21 ' A' ' 24' ' ' VAL . 47.2 mm-40 -98.17 110.19 55.1 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 123.607 0.763 . . . . 0.0 109.356 175.539 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.479 ' O ' HG12 ' A' ' 42' ' ' ILE . 61.7 Cg_endo -68.99 176.43 6.2 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.257 1.972 . . . . 0.0 112.114 172.646 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -60.08 -23.22 63.61 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.501 0.72 . . . . 0.0 112.354 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -58.45 -38.85 78.35 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 124.223 1.009 . . . . 0.0 110.975 172.077 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -94.18 -15.7 24.36 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.346 1.058 . . . . 0.0 112.457 -173.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 38' ' ' PRO . 46.6 mm -83.69 147.15 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 123.567 0.747 . . . . 0.0 112.121 -173.439 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -88.2 -70.47 0.63 Allowed 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.827 0.851 . . . . 0.0 109.896 172.96 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -77.42 115.97 53.88 Favored Pre-proline 0 CA--C 1.55 0.956 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 -176.094 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.3 -18.95 20.18 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.713 2.275 . . . . 0.0 112.955 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.455 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 75.2 mtm180 -73.99 -15.04 61.11 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.718 0.807 . . . . 0.0 111.974 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.9 mt -53.43 -52.55 59.04 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.029 0.932 . . . . 0.0 112.13 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.66 -34.97 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.238 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.455 ' SD ' ' HA ' ' A' ' 46' ' ' ARG . 57.5 mtt -59.97 -43.27 95.2 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.49 0.716 . . . . 0.0 111.017 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.62 78.48 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.389 0.676 . . . . 0.0 111.412 176.783 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -73.93 -32.94 63.75 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -75.38 -20.49 58.94 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.585 0.754 . . . . 0.0 112.118 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 . . . . . 0 N--CA 1.476 0.858 0 C-N-CA 123.081 0.552 . . . . 0.0 111.267 173.216 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt . . . . . 0 C--O 1.243 0.715 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -96.03 137.96 34.35 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.063 0.545 . . . . 0.0 110.557 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.99 167.52 12.08 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 169.884 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 26' ' ' ARG . . . . . 0.403 ' HD3' HG22 ' A' ' 4' ' ' VAL . 60.1 ttp180 . . . . . 0 N--CA 1.469 0.499 0 CA-C-O 121.355 0.598 . . . . 0.0 109.565 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 . . . . . 0 CA--C 1.543 0.695 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.38 134.24 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.342 1.057 . . . . 0.0 109.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -132.52 159.02 40.62 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 123.227 0.611 . . . . 0.0 109.633 172.365 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.03 124.97 24.54 Favored 'General case' 0 C--O 1.249 1.064 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 170.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.468 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 6.3 p -113.59 145.86 18.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 C-N-CA 124.019 0.927 . . . . 0.0 110.349 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -78.67 -61.59 1.96 Allowed 'General case' 0 C--O 1.245 0.828 0 C-N-CA 124.042 0.937 . . . . 0.0 109.935 179.123 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.7 p -167.47 -172.09 1.85 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.041 0.936 . . . . 0.0 110.024 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.433 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.4 mm -102.2 133.6 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.14 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.476 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -85.62 -58.67 2.57 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.359 1.063 . . . . 0.0 109.19 -177.986 . . . . . . . . 3 3 . 1 . 013 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.498 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 68.6 mttm -132.54 179.68 5.99 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.788 0.835 . . . . 0.0 110.264 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -156.24 154.63 31.03 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -169.977 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -164.41 170.54 15.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.421 1.088 . . . . 0.0 109.454 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.72 112.94 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 171.724 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -129.9 112.7 13.8 Favored 'General case' 0 C--O 1.24 0.585 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -174.013 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 80.6 tttt 63.77 33.92 12.45 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.021 1.328 . . . . 0.0 110.199 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.32 -14.85 43.16 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.236 -0.893 . . . . 0.0 113.744 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -84.2 112.38 20.21 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.412 0.685 . . . . 0.0 109.643 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.12 106.52 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -103.77 137.16 42.18 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.959 0.904 . . . . 0.0 110.755 -170.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.433 ' HB3' HD12 ' A' ' 10' ' ' ILE . 87.3 m-85 -119.0 126.83 52.64 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 124.326 1.05 . . . . 0.0 109.224 -171.73 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.498 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 33.4 tp -74.47 84.67 2.01 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.268 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.453 HG21 HD11 ' A' ' 42' ' ' ILE . 68.4 t -64.71 108.24 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 124.625 1.17 . . . . 0.0 111.174 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.6 tptp -94.64 102.23 14.12 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.241 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.568 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 21.1 m95 -74.72 152.58 39.09 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.663 0.785 . . . . 0.0 110.162 -178.0 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -80.7 -29.24 36.48 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 122.218 0.207 . . . . 0.0 111.262 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.36 -3.87 62.89 Favored Glycine 0 C--N 1.346 1.115 0 O-C-N 123.479 0.487 . . . . 0.0 113.023 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.568 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 62.0 m95 -124.23 127.86 25.2 Favored Pre-proline 0 CA--C 1.553 1.072 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -60.44 163.78 14.42 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 123.066 2.511 . . . . 0.0 112.234 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -61.93 -10.15 16.61 Favored 'Trans proline' 0 C--N 1.386 2.545 0 C-N-CA 123.007 2.471 . . . . 0.0 114.843 -174.419 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.84 -31.29 71.81 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.815 0.279 . . . . 0.0 110.902 172.159 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 60.6 m-85 -98.51 10.82 40.06 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 112.122 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.2 p -68.69 125.06 25.38 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.5 p -112.95 129.97 56.29 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.631 0.772 . . . . 0.0 111.588 -169.313 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -68.94 82.26 0.31 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.651 0.78 . . . . 0.0 110.708 175.845 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.414 ' HB2' HD11 ' A' ' 42' ' ' ILE . 21.5 mm-40 -107.9 115.68 58.39 Favored Pre-proline 0 C--O 1.243 0.749 0 C-N-CA 123.774 0.829 . . . . 0.0 109.149 177.583 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.461 ' O ' HG12 ' A' ' 42' ' ' ILE . 41.9 Cg_endo -63.68 168.91 10.84 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.481 2.121 . . . . 0.0 112.048 170.346 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.5 -19.34 63.49 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.17 -37.79 78.2 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.864 0.865 . . . . 0.0 111.129 169.122 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 36.2 m170 -87.37 -18.18 30.65 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 112.342 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.528 HD12 ' HB1' ' B' ' 25' ' ' ALA . 42.0 mm -93.74 146.15 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 124.277 0.986 . . . . 0.0 111.657 -172.019 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.499 HD11 ' HE ' ' B' ' 26' ' ' ARG . 95.6 mt -87.91 -65.51 1.01 Allowed 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.577 0.751 . . . . 0.0 110.87 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -72.12 124.27 90.62 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 122.921 0.489 . . . . 0.0 110.143 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.57 -17.88 20.36 Favored 'Trans proline' 0 C--N 1.374 1.879 0 C-N-CA 122.734 2.289 . . . . 0.0 112.995 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.543 ' HA ' ' HB3' ' A' ' 49' ' ' MET . 54.4 mtm180 -73.66 -11.44 60.41 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.784 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.77 -53.7 48.62 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.217 0.917 . . . . 0.0 110.925 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.7 p -69.3 -44.0 80.78 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.156 176.726 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.543 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 23.2 ttt -57.05 -41.95 79.63 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.395 0.678 . . . . 0.0 111.92 -177.213 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.14 73.86 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.936 0.894 . . . . 0.0 110.436 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -75.17 -28.14 59.96 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.67 176.436 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 23.8 mm-40 -81.82 -6.86 59.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.773 0.429 . . . . 0.0 111.822 177.118 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 . . . . . 0 N--CA 1.483 1.206 0 C-N-CA 122.898 0.479 . . . . 0.0 111.513 175.861 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mttp . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -138.75 111.26 7.55 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.378 0.671 . . . . 0.0 109.502 176.097 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.528 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -99.37 167.53 10.58 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.868 174.515 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 26' ' ' ARG . . . . . 0.499 ' HE ' HD11 ' A' ' 43' ' ' LEU . 15.2 ttm180 . . . . . 0 C--O 1.24 0.584 0 C-N-CA 123.255 0.622 . . . . 0.0 109.531 -176.704 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 . . . . . 0 N--CA 1.475 0.811 0 CA-C-O 121.471 0.653 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.7 t -117.42 131.99 68.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.797 1.639 . . . . 0.0 107.871 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' PHE . . . . . 0.421 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 69.1 m-85 -132.66 164.45 26.69 Favored 'General case' 0 C--O 1.248 0.98 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 173.413 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 104.93 1.54 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 168.184 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.519 HG13 HD11 ' A' ' 47' ' ' LEU . 2.9 p -89.57 138.57 19.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.711 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.08 -178.302 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.598 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 38.2 tt0 -71.81 -62.56 1.37 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.231 1.012 . . . . 0.0 109.561 176.52 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.404 ' HA ' HD12 ' A' ' 47' ' ' LEU . 27.7 p -173.6 -172.57 0.78 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.512 1.125 . . . . 0.0 109.216 -177.219 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.447 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.4 mm -94.78 133.16 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 169.241 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -99.2 -37.06 9.45 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.186 0.594 . . . . 0.0 110.558 -174.489 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.441 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 65.9 mttm -143.69 169.96 16.76 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.992 0.917 . . . . 0.0 109.921 176.54 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -152.48 149.29 28.39 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -174.806 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -163.71 -175.47 4.15 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.414 1.085 . . . . 0.0 109.487 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -144.02 141.63 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 173.445 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -137.9 107.89 6.35 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.616 0.767 . . . . 0.0 109.045 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.4 mttt 61.75 36.5 16.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.869 0.868 . . . . 0.0 111.482 173.559 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.62 -13.82 66.46 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.57 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -88.12 107.45 18.77 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.9 t -83.53 108.49 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -96.52 138.75 33.64 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.465 0.706 . . . . 0.0 110.197 -169.928 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.447 ' HB3' HD12 ' A' ' 10' ' ' ILE . 71.1 m-85 -122.66 121.94 37.61 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.898 0.879 . . . . 0.0 108.633 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.441 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 26.1 tp -71.68 86.64 0.93 Allowed 'General case' 0 C--O 1.24 0.583 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 174.424 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 78.4 t -70.85 104.82 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.494 -176.237 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -81.37 100.24 9.13 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.421 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 21.7 m95 -76.14 124.43 27.41 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 172.497 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.598 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -72.37 113.93 9.94 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.658 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 118.07 -14.65 12.4 Favored Glycine 0 C--N 1.346 1.139 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.215 -172.494 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -110.07 135.19 20.54 Favored Pre-proline 0 N--CA 1.475 0.799 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.29 155.24 30.68 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.746 2.297 . . . . 0.0 112.869 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.43 -13.44 10.29 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 123.52 2.813 . . . . 0.0 114.298 176.531 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -82.75 -46.47 13.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.693 0.397 . . . . 0.0 110.196 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -79.68 -1.36 37.99 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.252 0.621 . . . . 0.0 112.206 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.6 p -64.68 132.14 48.87 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 165.951 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.1 p -109.75 138.21 46.44 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.039 0.536 . . . . 0.0 111.98 -166.428 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -74.29 87.31 1.98 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.41 0.684 . . . . 0.0 110.107 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -103.74 125.1 35.63 Favored Pre-proline 0 N--CA 1.468 0.473 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.43 ' O ' HG12 ' A' ' 42' ' ' ILE . 56.3 Cg_endo -67.55 166.37 24.14 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 121.845 1.697 . . . . 0.0 112.447 172.451 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -52.24 -31.08 30.64 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 125.457 1.503 . . . . 0.0 112.337 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -60.45 -35.75 76.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.518 1.527 . . . . 0.0 110.99 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -91.65 -14.34 30.29 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.2 1.0 . . . . 0.0 112.989 -175.073 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 38' ' ' PRO . 41.2 mm -88.41 153.07 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.076 0.55 . . . . 0.0 110.914 -175.45 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' B' ' 24' ' ' ALA . 89.1 mt -90.85 -67.22 0.86 Allowed 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 171.842 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -82.97 134.61 46.27 Favored Pre-proline 0 CA--C 1.565 1.555 0 C-N-CA 123.001 0.521 . . . . 0.0 110.588 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' PRO . . . . . 0.43 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 88.9 Cg_endo -79.83 -32.04 1.66 Allowed 'Trans proline' 0 CA--C 1.571 2.342 0 C-N-CA 122.72 2.28 . . . . 0.0 116.072 -177.549 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.43 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.26 0.0 OUTLIER -71.42 -11.38 60.85 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -166.739 . . . . . . . . 4 4 . 1 . 014 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.519 HD11 HG13 ' A' ' 7' ' ' VAL . 2.9 mm? -53.54 -46.63 70.25 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.807 0.731 . . . . 0.0 110.203 171.278 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 98.1 t -70.26 -42.38 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.758 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -68.98 -42.43 76.55 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.406 -175.095 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.21 -30.91 71.85 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.951 0.9 . . . . 0.0 111.868 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.02 -52.27 25.49 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.015 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -81.76 -17.7 46.78 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -172.032 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 . . . . . 0 N--CA 1.486 1.326 0 CA-C-N 117.992 0.36 . . . . 0.0 111.742 -176.268 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 23' ' ' LYS . . . . . 0.483 ' HE3' ' HA ' ' B' ' 23' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 24' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' A' ' 43' ' ' LEU . . . -117.79 112.34 20.27 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.874 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -103.08 168.61 9.07 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 166.947 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 . . . . . 0 N--CA 1.471 0.58 0 CA-C-O 120.789 0.328 . . . . 0.0 110.139 -172.488 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 121.338 0.59 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 39.1 t -105.33 140.31 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 114.255 -1.339 . . . . 0.0 109.371 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -132.1 152.27 51.31 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.776 0.83 . . . . 0.0 109.166 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.03 128.27 35.09 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.46 132.47 70.62 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.439 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -69.29 -61.7 1.68 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.996 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.8 p -167.59 -169.34 1.18 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.758 -172.454 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.527 HD12 ' HB3' ' A' ' 22' ' ' TYR . 51.2 mm -105.5 139.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.418 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.432 ' HB3' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -92.64 -48.5 6.56 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.676 0.791 . . . . 0.0 109.97 -179.875 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -137.53 161.47 36.31 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.395 0.678 . . . . 0.0 111.156 -176.87 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -146.22 142.91 28.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.819 0.848 . . . . 0.0 109.179 -177.4 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -165.13 143.99 6.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.788 0.835 . . . . 0.0 109.137 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 7.2 p -92.09 125.29 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.943 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -133.15 104.52 6.54 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.992 0.517 . . . . 0.0 109.611 -169.415 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 62.52 30.64 17.16 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.008 0.923 . . . . 0.0 110.656 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 -17.46 51.07 Favored Glycine 0 C--N 1.348 1.237 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.569 -174.045 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -94.87 109.99 21.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.632 0.773 . . . . 0.0 109.272 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.7 t -79.24 111.44 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.024 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -90.53 143.75 26.45 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 123.696 0.798 . . . . 0.0 109.786 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.527 ' HB3' HD12 ' A' ' 10' ' ' ILE . 98.6 m-85 -125.94 123.51 38.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.315 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.432 HD23 ' HB3' ' A' ' 11' ' ' ARG . 43.1 tp -71.47 84.23 0.82 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 169.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.662 HG21 HD11 ' A' ' 42' ' ' ILE . 99.8 t -69.09 104.37 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.086 -172.395 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -78.06 99.76 6.24 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.899 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.535 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.8 m95 -69.07 139.54 54.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.958 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.18 -31.63 70.37 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 120.718 0.294 . . . . 0.0 110.559 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.74 -26.16 47.07 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.929 -0.578 . . . . 0.0 113.616 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 94.4 m95 -110.87 138.48 21.13 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 122.968 0.507 . . . . 0.0 111.363 -172.3 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -52.95 157.65 7.72 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.526 2.817 . . . . 0.0 113.248 173.359 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -57.82 -20.24 42.77 Favored 'Trans proline' 0 C--N 1.383 2.362 0 C-N-CA 123.327 2.685 . . . . 0.0 113.925 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -80.77 -31.39 35.87 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.377 0.671 . . . . 0.0 111.434 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -88.9 -4.37 58.48 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.383 0.673 . . . . 0.0 111.174 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.8 m -68.19 137.45 54.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.216 0.607 . . . . 0.0 109.606 172.071 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.9 p -111.88 143.2 43.23 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.051 0.541 . . . . 0.0 111.826 -170.079 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -75.57 85.66 2.64 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.669 0.788 . . . . 0.0 110.145 177.633 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.507 ' HB2' HD11 ' A' ' 42' ' ' ILE . 28.1 mm-40 -102.98 128.06 28.53 Favored Pre-proline 0 C--O 1.238 0.465 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.265 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.15 162.28 40.85 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.753 1.636 . . . . 0.0 110.9 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.98 -16.48 43.45 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.984 0.514 . . . . 0.0 112.01 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -55.67 -50.84 69.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.803 1.241 . . . . 0.0 109.996 170.014 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -76.96 -16.67 59.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.732 -174.515 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.662 HD11 HG21 ' A' ' 24' ' ' VAL . 46.0 mm -91.43 147.03 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.207 1.003 . . . . 0.0 111.161 -172.624 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 62.6 mt -87.34 -71.12 0.58 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 122.966 0.506 . . . . 0.0 109.641 172.511 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' ASP . . . . . 0.432 ' O ' HD23 ' A' ' 47' ' ' LEU . 14.3 t70 -68.92 112.58 11.94 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 122.919 0.488 . . . . 0.0 110.024 -176.596 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -81.65 -9.15 12.32 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.479 2.12 . . . . 0.0 113.187 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ttp180 -70.98 -16.54 62.64 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.787 0.835 . . . . 0.0 110.081 -178.197 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 44' ' ' ASP . 4.5 mm? -49.88 -47.39 52.01 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.759 0.824 . . . . 0.0 111.513 169.28 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.9 t -67.97 -50.43 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.823 0.849 . . . . 0.0 110.615 -178.089 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.411 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 25.8 mmt -58.5 -53.27 60.19 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.072 -177.04 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.89 78.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.574 1.15 . . . . 0.0 112.164 -177.09 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -62.63 -55.11 30.1 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.548 177.341 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -74.82 -6.18 47.62 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -170.467 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' MET . 60.7 mt-10 . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 121.02 0.438 . . . . 0.0 110.687 171.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 23' ' ' LYS . . . . . 0.419 ' HE2' HD22 ' A' ' 47' ' ' LEU . 7.3 mtpm? . . . . . 0 C--O 1.244 0.796 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -136.77 130.09 31.43 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.557 0.694 . . . . 0.0 110.28 -178.602 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.63 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -109.73 166.34 10.99 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.729 178.284 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 . . . . . 0 C--O 1.239 0.533 0 C-N-CA 123.343 0.657 . . . . 0.0 109.326 -172.106 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 . . . . . 0 N--CA 1.471 0.594 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.556 HG22 ' HB3' ' B' ' 26' ' ' ARG . 48.4 t -85.74 103.94 13.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 123.721 0.808 . . . . 0.0 109.092 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -129.38 174.13 9.9 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.458 0.703 . . . . 0.0 110.703 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.76 114.26 20.28 Favored 'General case' 0 C--O 1.245 0.864 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.013 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.613 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.7 p -107.72 149.49 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.658 1.183 . . . . 0.0 109.93 -178.831 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 8.1 tp10 -86.02 -59.0 2.42 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.925 0.393 . . . . 0.0 109.992 174.834 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 9' ' ' SER . . . . . 0.487 ' HA ' HD12 ' A' ' 47' ' ' LEU . 15.9 p -169.6 179.89 3.61 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.77 -171.289 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.592 HD12 ' HB3' ' A' ' 22' ' ' TYR . 40.9 mm -86.64 128.61 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 172.056 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.503 ' HD2' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -76.28 -49.3 17.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.887 0.875 . . . . 0.0 109.472 176.518 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.8 tttp -148.72 164.71 33.56 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.61 0.364 . . . . 0.0 110.054 -172.483 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -142.24 154.01 44.42 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.151 0.58 . . . . 0.0 109.462 -171.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 14' ' ' ARG . . . . . 0.568 ' HG3' ' HB2' ' A' ' 21' ' ' GLU . 10.0 ptm180 -171.45 -174.24 1.38 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.247 1.419 . . . . 0.0 108.831 179.394 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -143.71 142.51 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.496 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -137.33 104.65 5.44 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.584 0.754 . . . . 0.0 109.069 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm 59.72 34.35 22.03 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.786 1.234 . . . . 0.0 111.302 177.869 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.79 -14.57 65.01 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 115.241 -0.89 . . . . 0.0 114.292 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -85.2 109.87 18.62 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.6 t -78.22 111.05 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -175.488 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.568 ' HB2' ' HG3' ' A' ' 14' ' ' ARG . 5.3 mm-40 -95.86 140.27 30.87 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.865 0.866 . . . . 0.0 110.575 -168.648 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.592 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.6 m-85 -129.99 121.52 26.69 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.871 0.868 . . . . 0.0 109.146 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.503 HD23 ' HD2' ' A' ' 11' ' ' ARG . 24.0 tp -73.68 80.06 1.53 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.3 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.568 HG21 HD11 ' A' ' 42' ' ' ILE . 40.8 t -65.17 106.18 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.525 1.13 . . . . 0.0 109.708 -175.881 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.447 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 13.7 tptm -90.3 104.61 17.17 Favored 'General case' 0 C--O 1.243 0.749 0 C-N-CA 123.239 0.615 . . . . 0.0 110.019 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.613 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 36.9 m95 -77.56 127.07 31.89 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.238 1.015 . . . . 0.0 108.937 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.562 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -64.5 -28.8 69.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -166.466 . . . . . . . . 3 3 . 1 . 016 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.17 -2.81 54.46 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 116.749 -0.205 . . . . 0.0 113.209 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.595 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 76.9 m95 -111.44 150.09 41.6 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 123.642 0.777 . . . . 0.0 110.727 -173.174 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -64.73 158.54 50.02 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.861 2.374 . . . . 0.0 111.836 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -62.81 -18.53 64.98 Favored 'Trans proline' 0 C--N 1.378 2.103 0 C-N-CA 123.067 2.511 . . . . 0.0 113.686 -179.094 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -71.55 -30.01 65.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.573 0.349 . . . . 0.0 110.511 173.993 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -86.36 -5.03 59.26 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.712 0.805 . . . . 0.0 111.862 176.982 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 t -68.92 123.88 22.19 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 170.783 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.7 p -115.87 136.74 52.75 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.119 0.967 . . . . 0.0 112.12 -165.298 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -76.5 84.92 3.21 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 172.945 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.517 ' HB2' HD11 ' A' ' 42' ' ' ILE . 49.1 mm-40 -101.05 140.4 21.27 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 123.358 0.663 . . . . 0.0 109.222 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -78.48 158.97 29.07 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 121.794 1.663 . . . . 0.0 111.602 174.304 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -54.9 -25.01 26.27 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 123.907 0.883 . . . . 0.0 112.083 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -59.3 -31.46 69.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.685 1.194 . . . . 0.0 112.077 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -127.83 25.0 6.02 Favored 'General case' 0 C--O 1.25 1.083 0 C-N-CA 123.753 0.821 . . . . 0.0 112.538 -170.198 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.568 HD11 HG21 ' A' ' 24' ' ' VAL . 37.5 mm -103.9 150.8 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 125.041 1.336 . . . . 0.0 110.293 168.934 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.492 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 4.9 tt -81.23 -82.57 0.12 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.225 1.01 . . . . 0.0 108.826 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -78.5 132.51 65.35 Favored Pre-proline 0 CA--C 1.559 1.31 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -80.45 -16.82 10.46 Favored 'Trans proline' 0 C--N 1.377 2.028 0 C-N-CA 122.57 2.18 . . . . 0.0 113.711 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ARG . . . . . 0.438 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 65.1 mtm180 -71.98 -11.12 60.62 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.866 0.866 . . . . 0.0 113.203 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.497 HD11 HG13 ' A' ' 7' ' ' VAL . 3.1 mm? -58.7 -44.49 90.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 118.774 0.715 . . . . 0.0 109.812 167.657 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.37 -44.21 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.386 1.074 . . . . 0.0 110.52 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.438 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 96.0 mmm -65.25 -51.64 59.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.196 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.68 70.49 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.955 0.902 . . . . 0.0 111.547 179.029 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -65.92 -49.17 68.91 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.001 0.521 . . . . 0.0 110.304 175.572 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.17 -5.71 59.29 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.679 0.792 . . . . 0.0 112.28 -177.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 . . . . . 0 N--CA 1.481 1.083 0 C-N-CA 123.592 0.757 . . . . 0.0 110.191 168.434 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 121.112 0.482 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.2 134.31 47.65 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 171.657 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.54 -175.6 2.98 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 171.533 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 26' ' ' ARG . . . . . 0.556 ' HB3' HG22 ' A' ' 4' ' ' VAL . 4.5 ptp180 . . . . . 0 N--CA 1.467 0.396 0 C-N-CA 123.4 0.68 . . . . 0.0 109.591 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.689 0.281 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.9 t -100.66 140.12 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 124.189 0.995 . . . . 0.0 110.549 -177.337 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -142.28 163.28 33.29 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.062 0.945 . . . . 0.0 110.195 171.854 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.84 153.55 36.75 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.013 174.475 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.462 HG11 ' HB2' ' B' ' 25' ' ' ALA . 7.3 p -155.31 153.56 7.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.645 0 C-N-CA 124.311 1.045 . . . . 0.0 108.415 -176.457 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -121.9 -36.77 2.95 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.722 175.179 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -133.75 138.86 46.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.561 -166.06 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.8 mm -91.08 111.82 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 161.864 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.98 -54.19 14.38 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.708 0.63 . . . . 0.0 109.997 -173.943 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.421 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 99.2 mttt -139.2 176.84 8.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.823 0.849 . . . . 0.0 110.568 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -157.91 143.16 16.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.215 1.006 . . . . 0.0 108.933 -173.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -155.51 166.02 34.8 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.085 0.954 . . . . 0.0 108.582 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.4 t -127.86 114.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' ARG . . . . . 0.422 ' HD3' ' OE1' ' A' ' 21' ' ' GLU . 74.5 mtp180 -125.34 115.95 21.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 123.983 0.913 . . . . 0.0 108.92 -178.566 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt 64.21 24.76 13.47 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 125.458 1.503 . . . . 0.0 111.55 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.04 -16.04 60.5 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.755 -177.491 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.831 -0.804 . . . . 0.0 108.831 178.254 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 t -82.65 109.09 16.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.379 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.422 ' OE1' ' HD3' ' A' ' 16' ' ' ARG . 50.9 mt-10 -94.81 141.47 28.59 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.801 0.84 . . . . 0.0 110.279 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -120.18 120.49 36.31 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.784 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.421 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 33.9 tp -71.58 86.97 0.9 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.799 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.6 t -73.17 107.98 4.19 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.976 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.452 ' O ' HG23 ' A' ' 7' ' ' VAL . 20.5 tptm -78.69 99.89 6.81 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 175.945 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 68.0 m95 -69.94 129.67 40.12 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 175.202 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -20.59 62.2 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.006 0.366 . . . . 0.0 111.329 -176.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -99.05 7.46 60.47 Favored Glycine 0 C--N 1.354 1.57 0 C-N-CA 123.338 0.494 . . . . 0.0 113.626 178.702 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -133.7 141.1 38.78 Favored Pre-proline 0 N--CA 1.486 1.374 0 C-N-CA 123.639 0.776 . . . . 0.0 109.529 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -62.84 159.32 38.28 Favored 'Trans proline' 0 CA--C 1.565 2.031 0 C-N-CA 122.214 1.943 . . . . 0.0 110.717 168.287 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.22 0.56 4.41 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.083 2.522 . . . . 0.0 114.221 -174.018 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.09 -14.56 59.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.237 0.615 . . . . 0.0 111.562 170.651 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -119.27 7.25 11.24 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.663 0.785 . . . . 0.0 111.052 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.4 p -69.27 122.58 19.16 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 28.9 p -101.44 143.71 31.13 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.329 0.652 . . . . 0.0 111.314 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -76.82 86.35 3.41 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -94.5 113.08 60.1 Favored Pre-proline 0 N--CA 1.472 0.632 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 174.874 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 36.7 Cg_endo -64.71 172.48 6.86 Favored 'Trans proline' 0 C--N 1.371 1.728 0 C-N-CA 121.787 1.658 . . . . 0.0 113.616 175.703 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLU . . . . . 0.517 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 11.4 pt-20 -43.75 -41.86 5.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 126.696 1.998 . . . . 0.0 114.156 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' GLU . . . . . 0.517 ' HG3' ' HG3' ' A' ' 39' ' ' GLU . 24.2 mt-10 -75.09 -29.57 60.68 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.694 1.198 . . . . 0.0 111.015 -176.588 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -86.46 -2.96 58.9 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.405 1.082 . . . . 0.0 112.858 -172.171 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.87 149.73 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 124.889 1.276 . . . . 0.0 110.471 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.555 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 30.5 mt -81.98 -77.62 0.22 Allowed 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 167.624 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -68.31 110.53 5.89 Favored Pre-proline 0 C--N 1.362 1.12 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -170.357 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.68 -22.7 23.75 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.425 2.083 . . . . 0.0 112.076 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -70.81 -14.83 62.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.597 0.759 . . . . 0.0 111.443 -177.814 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.6 mt -57.29 -46.51 83.08 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.713 0.805 . . . . 0.0 111.227 170.846 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -63.05 -53.18 49.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.754 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.463 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 1.3 mpt? -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.23 0.956 . . . . 0.0 111.141 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.4 99.43 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.956 0.902 . . . . 0.0 110.74 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -63.84 -42.24 97.64 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.175 0.99 . . . . 0.0 110.391 174.768 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -76.12 -10.44 59.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.758 0.823 . . . . 0.0 112.953 -174.487 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 49' ' ' MET . 52.0 mt-10 . . . . . 0 N--CA 1.489 1.523 0 C-N-CA 122.473 0.309 . . . . 0.0 110.967 172.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -109.63 116.23 31.35 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.925 0.49 . . . . 0.0 110.42 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.462 ' HB2' HG11 ' A' ' 7' ' ' VAL . . . -94.54 -173.33 3.0 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 167.246 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' B' B ' 26' ' ' ARG . . . . . 0.555 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 15.3 ttt180 . . . . . 0 C--N 1.323 -0.581 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.26 -176.127 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 . . . . . 0 CA--C 1.544 0.749 0 CA-C-O 120.7 0.286 . . . . 0.0 111.603 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.79 139.73 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.504 1.122 . . . . 0.0 108.611 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -137.79 167.61 21.37 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.777 . . . . 0.0 109.989 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.06 124.5 25.09 Favored 'General case' 0 C--O 1.248 0.974 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.519 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.445 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -110.25 145.29 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.655 0.782 . . . . 0.0 110.534 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -90.0 -46.12 8.72 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.27 1.028 . . . . 0.0 110.763 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.4 p -175.46 -170.12 0.4 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.487 0.715 . . . . 0.0 110.663 -172.254 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.452 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.3 mm -111.79 120.98 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 168.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.423 ' HB3' HD23 ' A' ' 23' ' ' LEU . 0.4 OUTLIER -74.31 -56.25 5.09 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.077 0.951 . . . . 0.0 109.677 -179.313 . . . . . . . . 3 3 . 1 . 018 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.468 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 33.6 mtmm -137.61 176.52 8.63 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.962 0.905 . . . . 0.0 111.066 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -156.99 152.53 26.73 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.756 1.222 . . . . 0.0 108.448 -173.157 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -165.7 164.15 19.0 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.452 0.701 . . . . 0.0 109.723 177.216 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.481 HG22 HG22 ' A' ' 20' ' ' VAL . 38.6 t -108.87 126.92 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 166.2 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -139.0 105.77 5.38 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.413 1.085 . . . . 0.0 108.94 -170.334 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 62.26 26.86 16.11 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.375 1.07 . . . . 0.0 111.623 -176.278 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.08 -15.46 62.83 Favored Glycine 0 C--N 1.348 1.205 0 CA-C-N 115.733 -0.667 . . . . 0.0 113.175 -176.215 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.257 0.623 . . . . 0.0 110.009 178.631 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.481 HG22 HG22 ' A' ' 15' ' ' VAL . 43.7 t -76.21 104.47 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 175.751 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -98.62 149.29 22.93 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.527 0.731 . . . . 0.0 110.679 -176.014 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.452 ' HB3' HD12 ' A' ' 10' ' ' ILE . 92.8 m-85 -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.175 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LEU . . . . . 0.468 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 36.4 tp -70.12 86.71 0.56 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.028 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.425 HG21 HD11 ' A' ' 42' ' ' ILE . 75.7 t -70.63 107.35 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.106 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -79.79 102.07 8.85 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.544 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.0 m95 -77.28 154.27 33.1 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.648 -177.399 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -76.74 -33.25 58.13 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.419 0.687 . . . . 0.0 109.662 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.26 -25.51 28.42 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.529 -0.759 . . . . 0.0 113.414 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.544 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 97.6 m95 -106.54 135.22 19.53 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-N 117.338 0.569 . . . . 0.0 111.424 -176.564 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -53.98 158.76 8.38 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.461 2.774 . . . . 0.0 113.098 170.71 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -63.68 -16.81 56.96 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 123.225 2.617 . . . . 0.0 113.621 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -79.95 -36.72 35.77 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.884 0.474 . . . . 0.0 110.858 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -83.6 -5.76 59.26 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.322 0.649 . . . . 0.0 111.37 177.552 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.8 m -66.58 134.73 52.95 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 169.913 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.7 p -120.4 159.27 25.44 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.295 0.638 . . . . 0.0 111.824 -169.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.02 84.51 6.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.928 0.891 . . . . 0.0 110.464 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -101.34 111.79 64.16 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.44 177.121 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -61.57 165.51 13.33 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 122.135 1.89 . . . . 0.0 112.326 172.36 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -60.16 -21.45 61.67 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.216 1.007 . . . . 0.0 112.734 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.38 -33.04 71.89 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.249 1.02 . . . . 0.0 111.017 173.821 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -83.26 -29.88 28.07 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.538 -175.632 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.481 HD12 ' HB1' ' B' ' 25' ' ' ALA . 40.1 mm -88.83 144.87 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.936 0.895 . . . . 0.0 111.949 -165.817 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.0 mt -85.31 -72.79 0.47 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.426 0.69 . . . . 0.0 111.061 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.09 131.99 77.66 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -78.53 -18.63 12.05 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.666 2.244 . . . . 0.0 114.027 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -71.71 -13.19 61.65 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -172.03 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' LEU . . . . . 0.434 HD11 HG13 ' A' ' 7' ' ' VAL . 2.6 mm? -61.6 -47.38 85.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 168.223 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 48' ' ' VAL . . . . . 0.482 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 91.5 t -64.21 -46.54 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.649 176.895 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.2 mmt -57.82 -39.71 78.25 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.674 0.789 . . . . 0.0 111.566 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.25 85.24 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.201 1.0 . . . . 0.0 110.885 177.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' TYR . . . . . 0.416 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 68.1 t80 -73.14 -35.98 66.6 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.716 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 52' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 35.9 mm-40 -69.86 -13.1 62.1 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.193 0.597 . . . . 0.0 112.271 -175.527 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 . . . . . 0 N--CA 1.481 1.078 0 C-N-CA 123.583 0.753 . . . . 0.0 112.784 179.085 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 121.292 0.568 . . . . 0.0 111.598 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.82 108.02 18.67 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.804 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.481 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.06 155.42 16.81 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 163.027 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 . . . . . 0 C--N 1.321 -0.666 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -169.6 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 . . . . . 0 CA--C 1.548 0.887 0 CA-C-O 121.076 0.465 . . . . 0.0 111.084 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.5 t -112.47 124.84 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.389 1.076 . . . . 0.0 108.345 172.927 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -135.23 162.29 32.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.7 0.8 . . . . 0.0 109.623 178.078 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.91 107.06 5.09 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.448 0.699 . . . . 0.0 109.197 175.381 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' VAL . . . . . 0.523 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.1 p -85.43 135.0 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.09 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 8' ' ' GLU . . . . . 0.512 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.8 tp10 -69.11 -50.4 48.44 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.157 0.583 . . . . 0.0 109.758 175.031 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 p 178.76 -175.89 0.22 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.526 1.53 . . . . 0.0 108.853 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ILE . . . . . 0.516 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -85.62 122.77 38.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.05 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.604 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.5 tmt_? -67.82 -56.05 10.63 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.337 1.055 . . . . 0.0 109.194 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.427 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.8 mttt -140.81 157.92 44.7 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.116 -176.984 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -139.32 143.67 37.95 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.269 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -169.04 138.1 2.1 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.902 0.751 . . . . 0.0 109.924 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -86.16 124.28 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.196 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -127.07 105.2 8.42 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.483 1.113 . . . . 0.0 109.156 -173.189 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 59.51 32.95 22.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.57 1.148 . . . . 0.0 111.087 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.92 2.65 83.85 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.588 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -107.14 111.63 24.14 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.444 0.698 . . . . 0.0 109.827 174.627 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 t -74.18 110.52 8.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -93.7 144.04 25.76 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.156 0.982 . . . . 0.0 109.386 -173.493 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' TYR . . . . . 0.516 ' HB3' HD12 ' A' ' 10' ' ' ILE . 94.6 m-85 -128.86 109.36 11.2 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.617 0.767 . . . . 0.0 109.097 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.8 tp -67.36 97.11 0.54 Allowed 'General case' 0 C--N 1.345 0.388 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.467 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.1 t -76.47 105.93 5.86 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 C-N-CA 123.768 0.827 . . . . 0.0 110.131 -173.798 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.604 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.1 tptp -82.24 100.12 9.7 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.657 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 46.2 m95 -69.04 140.64 54.94 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.8 ttpt -59.98 -50.84 72.16 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 123.585 0.553 . . . . 0.0 111.874 -172.038 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.85 -28.41 31.81 Favored Glycine 0 C--N 1.341 0.819 0 CA-C-N 115.921 -0.581 . . . . 0.0 113.343 -177.784 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.657 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 58.1 m95 -89.26 123.83 66.12 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.713 0.405 . . . . 0.0 110.147 -175.318 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 30' ' ' PRO . . . . . 0.481 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 72.4 Cg_exo -53.76 164.92 2.05 Favored 'Trans proline' 0 C--N 1.38 2.205 0 C-N-CA 123.645 2.897 . . . . 0.0 113.979 174.749 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.75 -23.56 33.96 Favored 'Trans proline' 0 C--N 1.387 2.584 0 C-N-CA 123.674 2.916 . . . . 0.0 114.855 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' LYS . . . . . 0.481 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.4 pttt -66.3 -33.0 74.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.227 0.611 . . . . 0.0 112.124 176.021 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.468 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 75.0 m-85 -91.35 -13.39 32.6 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.274 0.63 . . . . 0.0 111.544 176.555 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.8 m -66.92 130.77 44.23 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.338 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.0 p -119.47 145.04 46.64 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.477 0.711 . . . . 0.0 111.164 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -76.2 79.51 3.0 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.575 0.75 . . . . 0.0 110.252 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -93.18 113.67 60.64 Favored Pre-proline 0 C--O 1.236 0.373 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 175.47 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.59 178.5 4.41 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.595 1.53 . . . . 0.0 113.271 -178.967 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -38.18 -42.71 0.7 Allowed 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 127.186 2.194 . . . . 0.0 115.214 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.91 -20.67 52.44 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.517 0.727 . . . . 0.0 111.995 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 38.2 m80 -112.73 16.78 19.5 Favored 'General case' 0 C--O 1.253 1.276 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -164.809 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 32.3 mm -101.69 152.64 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 125.474 1.51 . . . . 0.0 109.213 172.92 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.41 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 91.1 mt -83.45 -73.89 0.39 Allowed 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.08 0.4 . . . . 0.0 110.817 176.094 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.79 118.3 70.02 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.0 -19.92 26.07 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.557 2.171 . . . . 0.0 112.724 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -10.08 59.25 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.326 178.131 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -49.14 -42.04 38.25 Favored 'General case' 0 N--CA 1.507 2.392 0 CA-C-N 119.248 0.931 . . . . 0.0 110.412 167.489 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -51.57 57.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.918 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mmt -55.27 -42.36 73.46 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.856 0.862 . . . . 0.0 111.49 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.65 -39.43 88.22 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.871 1.268 . . . . 0.0 111.339 -175.892 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.68 -46.76 35.76 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.47 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -68.71 -6.3 25.46 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.449 0.7 . . . . 0.0 112.793 -170.957 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 . . . . . 0 CA--C 1.556 1.181 0 C-N-CA 123.524 0.73 . . . . 0.0 112.006 168.78 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp . . . . . 0 N--CA 1.48 1.046 0 CA-C-O 120.914 0.387 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.18 125.77 53.8 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.31 0.644 . . . . 0.0 110.117 174.202 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.59 175.51 9.1 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 124.189 0.996 . . . . 0.0 108.508 171.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 26' ' ' ARG . . . . . 0.41 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 45.0 ttp180 . . . . . 0 C--O 1.235 0.315 0 C-N-CA 123.065 0.546 . . . . 0.0 110.706 -173.455 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.3 t -116.67 140.8 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.963 1.305 . . . . 0.0 108.584 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -141.31 158.63 43.63 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.53 0.732 . . . . 0.0 110.373 171.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.75 114.87 11.36 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.588 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -87.27 138.76 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.345 1.058 . . . . 0.0 110.249 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -76.28 -57.4 3.89 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 122.922 0.489 . . . . 0.0 109.821 175.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.0 m -157.16 170.95 21.33 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.013 0.925 . . . . 0.0 110.16 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.2 mm -89.28 110.9 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 162.992 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.516 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.6 tmt_? -66.37 -58.46 5.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.348 1.059 . . . . 0.0 109.198 -177.846 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 12' ' ' LYS . . . . . 0.492 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.5 mtpp -137.58 170.88 15.31 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.774 0.83 . . . . 0.0 111.444 -177.68 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -156.68 129.4 7.7 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.432 1.093 . . . . 0.0 108.898 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -157.84 150.72 22.94 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.682 0.793 . . . . 0.0 109.235 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 20' ' ' VAL . 47.2 t -93.43 112.68 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 173.341 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -107.2 96.83 6.7 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.761 1.224 . . . . 0.0 108.751 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.3 tptt 62.11 49.28 4.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.645 1.178 . . . . 0.0 110.938 176.932 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 81.82 -18.28 12.94 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.677 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -86.68 110.54 19.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.005 0.922 . . . . 0.0 109.57 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 15' ' ' VAL . 21.4 t -78.71 103.75 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -98.41 144.95 27.22 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.235 1.014 . . . . 0.0 110.554 -173.546 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -126.32 119.92 28.59 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.089 0.956 . . . . 0.0 108.602 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.3 tp -70.72 90.81 0.79 Allowed 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 169.615 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.531 HG21 HD11 ' A' ' 42' ' ' ILE . 63.7 t -78.02 105.26 6.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 123.697 0.799 . . . . 0.0 109.95 -173.545 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.4 tptp -77.41 103.55 7.4 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.45 0.7 . . . . 0.0 109.14 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' TRP . . . . . 0.498 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -77.04 157.32 31.2 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 110.111 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -64.55 -41.98 95.98 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.931 0.492 . . . . 0.0 111.098 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.0 -24.39 35.08 Favored Glycine 0 C--N 1.346 1.098 0 CA-C-N 115.935 -0.575 . . . . 0.0 113.597 -177.152 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' TRP . . . . . 0.498 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 77.0 m95 -104.45 124.59 36.67 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 122.906 0.482 . . . . 0.0 111.055 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -52.98 163.66 1.99 Allowed 'Trans proline' 0 C--N 1.386 2.524 0 C-N-CA 124.056 3.17 . . . . 0.0 113.363 171.943 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -62.84 -26.64 74.77 Favored 'Trans proline' 0 C--N 1.385 2.497 0 C-N-CA 123.08 2.52 . . . . 0.0 113.448 -174.827 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -78.47 -26.25 46.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.069 0.548 . . . . 0.0 111.278 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' TYR . . . . . 0.402 ' HB3' ' HE3' ' A' ' 29' ' ' TRP . 87.3 m-85 -92.75 2.11 56.92 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.838 0.855 . . . . 0.0 111.391 175.041 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.0 m -76.3 155.73 34.0 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.369 0.667 . . . . 0.0 110.347 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.3 p -115.35 135.43 54.14 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.258 0.623 . . . . 0.0 112.481 -171.269 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -74.95 82.49 2.2 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.91 0.884 . . . . 0.0 110.286 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -106.06 123.07 40.26 Favored Pre-proline 0 N--CA 1.465 0.299 0 C-N-CA 123.751 0.82 . . . . 0.0 109.432 178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 38' ' ' PRO . . . . . 0.535 ' O ' HG12 ' A' ' 42' ' ' ILE . 38.3 Cg_endo -64.19 165.05 20.6 Favored 'Trans proline' 0 C--N 1.368 1.6 0 C-N-CA 122.361 2.04 . . . . 0.0 112.15 173.393 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -56.43 -27.92 57.97 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.192 0.997 . . . . 0.0 111.021 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -55.5 -45.26 77.06 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.604 1.561 . . . . 0.0 111.226 169.514 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 42.5 m170 -88.13 -7.29 57.15 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.066 0.946 . . . . 0.0 113.169 -176.177 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' ILE . . . . . 0.65 HD12 ' HB1' ' B' ' 25' ' ' ALA . 41.8 mm -94.26 139.22 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.814 0.846 . . . . 0.0 109.833 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 43' ' ' LEU . . . . . 0.579 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 94.9 mt -71.48 -64.76 0.86 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.833 0.453 . . . . 0.0 110.078 175.941 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.69 109.99 22.04 Favored Pre-proline 0 CA--C 1.556 1.184 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.161 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.8 -9.89 19.78 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.782 2.321 . . . . 0.0 112.704 -176.281 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 -72.89 -12.63 61.04 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.311 0.644 . . . . 0.0 111.341 -176.906 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.89 -43.38 86.07 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.914 0.486 . . . . 0.0 110.975 169.134 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.6 t -64.81 -42.05 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.693 0.797 . . . . 0.0 109.938 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' MET . . . . . 0.401 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 24.7 mmt -60.36 -47.49 85.81 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.276 177.189 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.9 80.4 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.507 1.123 . . . . 0.0 111.565 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -68.08 -34.08 75.75 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.89 0.876 . . . . 0.0 110.774 176.005 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -90.79 -9.06 47.95 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.932 0.493 . . . . 0.0 111.881 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 49' ' ' MET . 30.0 mm-40 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 122.933 0.493 . . . . 0.0 110.02 171.456 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.991 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 . . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -113.76 112.02 22.73 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.423 0.63 . . . . 0.0 110.63 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 25' ' ' ALA . . . . . 0.65 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -85.87 168.94 13.77 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.464 165.656 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' B' B ' 26' ' ' ARG . . . . . 0.579 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 23.1 ttt180 . . . . . 0 N--CA 1.471 0.611 0 CA-C-O 121.488 0.661 . . . . 0.0 111.289 -175.096 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.803 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -145.58 176.31 9.71 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.95 0.9 . . . . 0.0 110.659 -171.641 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.635 ' HB2' ' HB3' ' B' ' 27' ' ' M3L . 1.3 mp0 -82.08 81.73 7.92 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.624 0.77 . . . . 0.0 109.593 -174.695 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 71.3 t -82.51 120.8 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 109.622 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.425 ' HE2' ' HB3' ' A' ' 3' ' ' GLN . 86.8 m-85 -137.14 161.91 34.85 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.736 0.814 . . . . 0.0 109.676 178.367 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.89 129.87 37.64 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 174.654 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.419 HG13 HD11 ' A' ' 47' ' ' LEU . 2.7 p -111.25 143.11 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.507 1.123 . . . . 0.0 110.418 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.0 -58.99 2.96 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.468 1.107 . . . . 0.0 109.378 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.9 p -174.14 -172.28 0.69 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.402 1.081 . . . . 0.0 109.775 -176.141 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.444 HD12 ' HB3' ' A' ' 22' ' ' TYR . 48.2 mm -98.01 120.07 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.558 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -73.68 -53.93 9.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.127 0.971 . . . . 0.0 109.552 179.812 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.476 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 99.0 mttt -138.05 174.45 10.55 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.916 0.886 . . . . 0.0 111.342 -176.508 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -154.55 144.79 21.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.35 1.06 . . . . 0.0 108.724 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -161.45 -179.2 7.16 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.984 0.914 . . . . 0.0 109.538 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 41.2 t -135.14 118.76 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -136.83 129.85 30.95 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.333 1.053 . . . . 0.0 109.274 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm 62.68 24.92 14.84 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.994 0.918 . . . . 0.0 111.63 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.04 -8.44 60.42 Favored Glycine 0 C--N 1.352 1.424 0 CA-C-N 115.816 -0.629 . . . . 0.0 113.232 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -85.87 117.99 25.07 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 123.84 0.856 . . . . 0.0 108.935 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.7 t -79.09 104.8 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -97.68 139.08 34.11 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.946 0.898 . . . . 0.0 110.139 -170.596 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.444 ' HB3' HD12 ' A' ' 10' ' ' ILE . 15.1 m-85 -118.13 121.3 40.18 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.452 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 28.0 tp -74.8 94.64 2.79 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 172.51 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.8 t -76.69 105.98 6.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.622 0.769 . . . . 0.0 109.97 -174.828 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.491 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.0 tptp -81.65 106.92 13.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.053 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.621 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 77.4 m95 -77.16 149.97 35.56 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.571 0.748 . . . . 0.0 110.787 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -77.44 -34.06 54.63 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.076 0.55 . . . . 0.0 111.322 -174.131 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.51 15.31 42.13 Favored Glycine 0 C--N 1.343 0.944 0 CA-C-N 116.229 -0.442 . . . . 0.0 113.008 -178.684 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.621 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 88.8 m95 -133.48 136.83 27.69 Favored Pre-proline 0 C--O 1.246 0.887 0 C-N-CA 123.125 0.57 . . . . 0.0 110.067 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.443 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 88.4 Cg_exo -52.21 158.05 5.72 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 123.355 2.704 . . . . 0.0 113.333 167.965 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.42 5.54 1.53 Allowed 'Trans proline' 0 C--N 1.377 2.049 0 C-N-CA 123.406 2.737 . . . . 0.0 114.603 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.443 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.0 pttt -90.03 -15.88 30.91 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.779 0.431 . . . . 0.0 110.923 170.106 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 97.7 m-85 -96.32 -2.6 45.47 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.54 0.736 . . . . 0.0 111.441 174.298 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -63.53 122.52 16.49 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.069 0.547 . . . . 0.0 110.727 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.8 p -102.43 135.91 43.21 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.74 0.816 . . . . 0.0 111.366 -172.057 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -76.33 75.37 3.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.276 0.63 . . . . 0.0 109.494 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -90.65 117.95 68.33 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.19 169.16 15.78 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 121.996 1.797 . . . . 0.0 111.756 173.776 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -50.11 -39.41 42.78 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.985 1.314 . . . . 0.0 114.378 -171.579 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.78 -1.47 54.33 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.401 ' O ' ' HG3' ' B' ' 26' ' ' ARG . 27.3 m-70 -115.72 14.19 16.35 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.881 0.873 . . . . 0.0 111.236 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 28.9 mm -103.42 150.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 126.11 1.764 . . . . 0.0 109.541 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.435 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 5.6 tt -89.44 -79.47 0.33 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.41 ' O ' HD23 ' A' ' 47' ' ' LEU . 13.3 t70 -80.66 126.63 77.71 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.164 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -80.45 -13.7 12.07 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.755 2.304 . . . . 0.0 114.247 -175.553 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -15.11 62.74 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.387 0.675 . . . . 0.0 112.74 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.419 HD11 HG13 ' A' ' 7' ' ' VAL . 3.9 mm? -58.42 -53.27 60.19 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 118.335 0.516 . . . . 0.0 111.715 178.573 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.14 -32.53 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.876 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.497 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmt -62.4 -52.34 63.97 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 175.452 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.25 72.24 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.494 1.118 . . . . 0.0 111.58 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -62.82 -47.37 83.71 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.206 1.003 . . . . 0.0 110.928 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.34 -9.9 59.29 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 49' ' ' MET . 27.3 mm-40 -63.6 -31.02 72.06 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-O 120.942 0.401 . . . . 0.0 110.447 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -95.45 -23.17 17.25 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.168 0.987 . . . . 0.0 110.708 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -65.73 140.47 58.45 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.728 0.811 . . . . 0.0 111.061 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 123.799 0.84 . . . . 0.0 109.245 178.703 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 97.1 mt -85.26 85.42 7.46 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -87.06 126.33 34.69 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.132 177.599 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.0 t -73.29 82.45 1.37 Allowed 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 122.413 1.102 . . . . 0.0 109.353 172.819 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -118.34 148.1 42.83 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 114.312 -1.313 . . . . 0.0 109.395 -176.876 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -130.15 127.4 39.67 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.076 0.951 . . . . 0.0 108.824 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.91 -174.0 2.36 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.492 ' HD3' ' OG ' ' B' ' 28' ' ' SER . 9.7 ptp180 -145.0 158.08 43.93 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.47 0.708 . . . . 0.0 109.837 -176.162 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.635 ' HB3' ' HB2' ' A' ' 3' ' ' GLN . . . . . . . . 0 C--O 1.245 0.863 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 169.486 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.492 ' OG ' ' HD3' ' B' ' 26' ' ' ARG . 48.3 m -75.44 -13.73 60.4 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.442 173.04 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . 70.7 131.63 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.834 1.654 . . . . 0.0 112.44 174.166 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -60.39 -29.16 88.19 Favored 'Trans proline' 0 C--N 1.377 2.061 0 C-N-CA 122.398 2.065 . . . . 0.0 111.721 167.904 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -105.03 98.69 8.36 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.379 1.072 . . . . 0.0 109.632 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.1 t -155.36 139.36 16.37 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.776 0.831 . . . . 0.0 109.905 -178.634 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.198 0 CA-C-O 119.173 -0.793 . . . . 0.0 111.891 -179.246 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -123.24 93.33 3.92 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.62 0.768 . . . . 0.0 108.966 -179.036 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -152.0 102.35 2.8 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.336 0.654 . . . . 0.0 109.686 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 t -109.68 144.32 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 124.273 1.029 . . . . 0.0 108.612 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.548 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 72.8 m-85 -128.97 160.73 31.77 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 167.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.48 114.13 10.27 Favored 'General case' 0 C--O 1.242 0.673 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 166.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.414 HG12 ' O ' ' B' ' 23' ' ' LYS . 3.1 p -92.95 137.88 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.083 0.553 . . . . 0.0 111.331 -172.054 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.653 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.8 tt0 -63.12 -59.56 4.61 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.714 0.806 . . . . 0.0 109.496 174.487 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.3 p -176.73 176.53 1.5 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-N 113.621 -1.627 . . . . 0.0 108.844 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.522 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.4 mm -82.95 115.6 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -53.56 18.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.184 0.594 . . . . 0.0 110.279 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -133.96 166.32 22.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.565 0.746 . . . . 0.0 110.566 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -151.06 142.2 23.15 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -154.42 173.23 16.52 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.447 0.699 . . . . 0.0 109.318 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.03 125.03 9.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.966 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.3 ptt180 -139.9 122.22 15.99 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.651 0.78 . . . . 0.0 109.296 178.489 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 62.62 26.45 15.68 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.853 1.261 . . . . 0.0 110.667 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.46 -8.01 80.49 Favored Glycine 0 C--N 1.354 1.543 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.712 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 70.2 mmtt -89.77 112.96 24.42 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 117.252 0.526 . . . . 0.0 110.858 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.2 t -89.36 108.33 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.37 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -96.76 155.73 16.65 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.243 0.617 . . . . 0.0 110.738 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.522 ' HB3' HD12 ' A' ' 10' ' ' ILE . 66.2 m-85 -132.99 112.22 11.66 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.142 0.977 . . . . 0.0 108.693 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.26 90.58 0.5 Allowed 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.617 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.26 106.91 4.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.521 0.728 . . . . 0.0 111.305 -173.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -82.8 107.25 15.29 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 52.9 m95 -71.45 149.25 46.06 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.853 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.653 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 26.7 ttpp -67.48 -65.43 0.69 Allowed 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.319 0.648 . . . . 0.0 112.614 -166.102 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.21 41.07 2.72 Favored Glycine 0 N--CA 1.467 0.763 0 CA-C-N 116.583 -0.28 . . . . 0.0 112.759 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.512 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.7 m95 -139.57 133.97 16.03 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 123.715 0.806 . . . . 0.0 109.385 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -59.71 157.31 33.22 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 122.775 2.317 . . . . 0.0 112.374 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.55 -15.23 19.32 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 124.046 3.164 . . . . 0.0 115.328 -172.754 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.52 -25.19 67.88 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -87.39 -5.1 59.0 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.463 0.705 . . . . 0.0 112.619 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.1 p -66.6 125.83 27.0 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.426 HG21 HM22 ' B' ' 27' ' ' M3L . 21.4 p -118.36 135.91 54.05 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.692 0.797 . . . . 0.0 110.904 -173.239 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -68.81 85.4 0.32 Allowed 'General case' 0 C--N 1.356 0.874 0 C-N-CA 123.276 0.63 . . . . 0.0 109.389 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -100.64 102.83 20.63 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.059 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -62.91 178.92 0.86 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 122.513 2.142 . . . . 0.0 113.234 173.8 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -59.13 -24.19 62.79 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.8 mp0 -73.84 -23.18 59.6 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.175 0.59 . . . . 0.0 111.979 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -94.56 -19.27 20.65 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -168.241 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.46 HG23 ' HA ' ' B' ' 25' ' ' ALA . 33.2 mm -90.81 149.36 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.76 0.824 . . . . 0.0 110.613 -174.17 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -86.34 -71.94 0.52 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.214 0.606 . . . . 0.0 109.617 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -72.03 126.68 91.2 Favored Pre-proline 0 CA--C 1.562 1.407 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.533 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -76.43 -23.23 11.71 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.575 2.183 . . . . 0.0 113.796 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.405 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 88.8 mtm180 -69.87 -12.83 61.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.33 1.052 . . . . 0.0 113.59 -168.95 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.438 ' HB3' HG12 ' A' ' 10' ' ' ILE . 3.0 mm? -57.31 -40.63 78.26 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 118.116 0.416 . . . . 0.0 110.693 171.525 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.63 -43.95 93.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.059 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.426 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 1.5 mpt? -61.95 -50.58 71.56 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.589 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.32 -34.97 74.55 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.283 1.033 . . . . 0.0 111.797 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.34 -39.69 94.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.039 0.936 . . . . 0.0 110.926 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -87.15 -10.68 52.1 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.735 0.814 . . . . 0.0 111.942 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' MET . 41.0 mm-40 -77.9 -34.93 51.25 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 122.856 0.463 . . . . 0.0 110.785 175.025 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -83.07 -177.67 6.84 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.878 0.471 . . . . 0.0 110.615 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -77.11 109.83 11.27 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.371 0.669 . . . . 0.0 109.459 175.945 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.562 1.433 0 C-N-CA 124.476 1.111 . . . . 0.0 109.832 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 . . . . . 0 N--CA 1.483 1.182 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 52.9 tp 62.95 93.83 0.05 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.841 1.256 . . . . 0.0 109.88 -176.188 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -144.59 131.38 20.17 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.455 0.702 . . . . 0.0 109.54 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 12.3 t -80.34 135.5 36.21 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.551 0.691 . . . . 0.0 110.85 -177.733 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 23' ' ' LYS . . . . . 0.414 ' O ' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -112.98 -174.04 2.37 Favored 'General case' 0 C--O 1.247 0.97 0 C-N-CA 124.359 1.064 . . . . 0.0 108.694 176.056 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -102.03 104.3 14.95 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.164 0.506 . . . . 0.0 110.647 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.46 ' HA ' HG23 ' A' ' 42' ' ' ILE . . . -103.85 142.34 34.57 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 164.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -132.21 149.99 52.26 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.104 0.561 . . . . 0.0 110.092 -172.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.426 HM22 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.539 0.555 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.028 171.409 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 12.7 t 76.45 161.08 0.23 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.346 1.058 . . . . 0.0 112.947 168.633 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . 66.36 90.24 0.09 OUTLIER Pre-proline 0 N--CA 1.483 1.204 0 C-N-CA 125.213 1.405 . . . . 0.0 110.876 -176.955 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -73.95 95.8 0.91 Allowed 'Trans proline' 0 C--N 1.374 1.87 0 C-N-CA 122.371 2.047 . . . . 0.0 111.478 -179.197 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.06 95.33 0.38 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.209 0.604 . . . . 0.0 110.615 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 26.5 m -72.07 114.89 10.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.473 0.709 . . . . 0.0 111.518 -176.519 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.811 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 179.616 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.419 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.551 ' HB2' ' HD2' ' B' ' 26' ' ' ARG . 15.2 pt-20 -81.83 97.62 8.09 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.453 0.644 . . . . 0.0 109.534 178.101 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.475 ' HB2' ' HB3' ' B' ' 27' ' ' M3L . 83.8 mt-30 -82.45 79.34 8.92 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.493 0.717 . . . . 0.0 110.635 -175.592 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 46.0 t -83.65 125.01 40.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.482 1.113 . . . . 0.0 109.512 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.401 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 68.8 m-85 -133.44 147.01 51.68 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.937 0.495 . . . . 0.0 110.421 176.952 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.66 111.32 4.73 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.1 p -89.37 144.14 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.685 0.794 . . . . 0.0 110.736 -176.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -81.92 -61.19 1.99 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.739 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.6 m -158.35 171.58 19.91 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.937 0.895 . . . . 0.0 110.221 -174.7 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.468 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 34.7 mm -92.81 117.5 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 163.534 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.01 -46.91 27.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.944 0.898 . . . . 0.0 109.887 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -151.65 166.1 32.3 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.532 0.733 . . . . 0.0 109.765 -176.61 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -146.97 152.21 38.26 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.242 1.017 . . . . 0.0 109.68 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -165.15 167.69 17.91 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.367 1.467 . . . . 0.0 108.526 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 13.6 p -118.42 145.35 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 172.898 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -142.81 96.02 2.87 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.178 0.591 . . . . 0.0 109.602 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm 55.96 39.19 30.58 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.546 1.138 . . . . 0.0 111.554 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.48 -19.51 52.2 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.752 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -85.75 108.29 18.01 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.661 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 11.3 t -85.9 109.77 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -175.29 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -93.82 136.53 34.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.896 0.878 . . . . 0.0 109.657 -170.38 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -124.48 122.79 38.61 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -71.63 85.87 0.89 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 170.009 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.614 HG21 HD11 ' A' ' 42' ' ' ILE . 65.8 t -77.43 107.03 8.35 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.741 -173.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -74.54 102.84 4.65 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.233 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.604 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.7 m95 -74.18 138.0 43.49 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.498 177.132 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -77.95 -17.9 56.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.008 0.523 . . . . 0.0 111.35 -172.223 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.37 13.76 28.08 Favored Glycine 0 C--N 1.346 1.116 0 C-N-CA 123.107 0.384 . . . . 0.0 112.994 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.604 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.2 m95 -130.88 147.16 65.14 Favored Pre-proline 0 N--CA 1.482 1.173 0 C-N-CA 123.592 0.757 . . . . 0.0 110.537 178.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -55.13 157.26 14.12 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.212 2.608 . . . . 0.0 113.254 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -63.92 -16.74 56.6 Favored 'Trans proline' 0 C--N 1.384 2.409 0 C-N-CA 123.122 2.548 . . . . 0.0 113.338 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.67 -27.94 30.98 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.009 0.524 . . . . 0.0 111.465 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -86.76 -1.43 57.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.628 0.771 . . . . 0.0 111.174 175.557 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.6 m -67.11 117.99 9.91 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 170.362 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.559 HG21 HM12 ' B' ' 27' ' ' M3L . 23.0 p -106.58 151.66 24.73 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.361 0.664 . . . . 0.0 111.269 -172.505 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -79.19 89.28 4.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.281 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -100.45 119.1 59.76 Favored Pre-proline 0 C--O 1.239 0.53 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.47 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -69.46 171.23 14.5 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.296 1.998 . . . . 0.0 112.073 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -61.9 -19.45 62.68 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.654 0.782 . . . . 0.0 112.13 177.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.499 ' O ' ' HD3' ' B' ' 30' ' ' PRO . 30.5 tt0 -56.88 -46.59 81.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.993 0.917 . . . . 0.0 110.224 168.997 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.8 m170 -85.47 -25.23 27.03 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.666 -172.835 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.614 HD11 HG21 ' A' ' 24' ' ' VAL . 48.1 mm -81.84 146.21 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.599 0.76 . . . . 0.0 111.624 -174.69 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.1 mt -86.47 -61.92 1.63 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.678 0.791 . . . . 0.0 110.098 173.029 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -72.55 112.68 15.93 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 123.397 0.679 . . . . 0.0 110.161 -172.592 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.49 -24.49 7.59 Favored 'Trans proline' 0 C--N 1.374 1.873 0 C-N-CA 122.582 2.188 . . . . 0.0 112.582 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -72.89 -21.15 60.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.271 1.028 . . . . 0.0 109.71 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 44.5 tp -55.22 -48.64 73.6 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.354 1.461 . . . . 0.0 112.234 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t -68.92 -36.03 72.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.216 -177.505 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.402 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 92.6 mmm -55.86 -45.51 78.48 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.086 0.866 . . . . 0.0 110.666 178.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.58 -33.43 63.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.964 0.905 . . . . 0.0 112.454 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.468 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 86.1 t80 -75.44 -46.03 35.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.113 0.965 . . . . 0.0 110.389 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.53 -11.89 61.1 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.652 0.781 . . . . 0.0 112.899 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 49' ' ' MET . 11.0 mm-40 -58.44 -32.25 68.53 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.323 0.582 . . . . 0.0 109.821 172.645 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.402 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 0.1 OUTLIER -88.5 108.0 19.17 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 173.043 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 66.92 81.14 0.2 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.42 1.488 . . . . 0.0 111.086 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 CA--C 1.558 1.288 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.761 179.646 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 55.3 tp -78.39 144.74 35.65 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.379 0.672 . . . . 0.0 109.731 176.792 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.29 119.42 5.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.197 0.599 . . . . 0.0 110.536 -177.458 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 26.9 m -87.33 86.84 7.29 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 175.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtpt -109.05 146.81 33.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.18 0.992 . . . . 0.0 108.661 -176.573 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -119.91 113.09 20.03 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 122.897 0.479 . . . . 0.0 110.232 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.463 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -96.4 172.66 7.8 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 169.486 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.551 ' HD2' ' HB2' ' A' ' 2' ' ' GLU . 49.7 ttp180 -152.59 158.09 41.96 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 -175.426 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.559 HM12 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.537 0.473 0 C-N-CA 123.639 0.776 . . . . 0.0 111.319 178.072 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 13.6 m -140.76 135.56 31.64 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 122.038 -0.414 . . . . 0.0 111.701 -167.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.56 154.48 94.44 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 124.13 0.972 . . . . 0.0 111.076 176.39 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 30' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 40' ' ' GLU . 38.7 Cg_exo -60.12 112.76 1.4 Allowed 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 123.038 2.492 . . . . 0.0 112.237 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.97 106.65 1.29 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.812 0.845 . . . . 0.0 110.858 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 15.4 t -155.86 21.87 0.39 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.08 0.952 . . . . 0.0 110.231 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.02 0 CA-C-O 118.91 -0.939 . . . . 0.0 111.512 -179.01 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.312 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -86.86 6.05 33.76 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.848 0.859 . . . . 0.0 111.806 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 28.1 mp0 -60.98 118.45 6.74 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.395 0.678 . . . . 0.0 112.174 -175.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.9 t -102.15 121.36 53.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 125.022 1.329 . . . . 0.0 107.978 172.631 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.427 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 52.4 m-85 -127.13 155.09 43.89 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 118.065 0.393 . . . . 0.0 110.338 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.97 114.75 6.78 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.82 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.464 HG13 HD11 ' A' ' 47' ' ' LEU . 4.1 p -103.97 137.52 32.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 C-N-CA 124.116 0.967 . . . . 0.0 111.073 -173.053 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.589 ' HA ' ' HB1' ' B' ' 21' ' ' ALA . 32.0 tt0 -74.87 -63.03 1.35 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.924 -177.554 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -165.48 -177.65 4.54 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.941 0.896 . . . . 0.0 110.385 -173.037 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.55 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.9 mm -86.95 109.68 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 169.301 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.628 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -68.76 -49.62 57.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.848 1.259 . . . . 0.0 109.408 -178.316 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -146.03 168.96 19.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.407 1.083 . . . . 0.0 109.788 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -155.18 138.73 15.97 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.969 0.908 . . . . 0.0 108.897 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -165.56 139.78 4.7 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.64 0.776 . . . . 0.0 109.714 174.532 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.97 118.63 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 CA-C-O 121.256 0.55 . . . . 0.0 110.625 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -107.53 101.3 10.64 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.022 0.929 . . . . 0.0 109.615 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 59.45 40.96 20.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.065 1.346 . . . . 0.0 112.642 174.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.81 -17.64 57.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-N 115.533 -0.758 . . . . 0.0 113.232 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -90.49 110.92 22.03 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.3 t -81.82 111.4 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -93.78 137.94 32.5 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 123.913 0.885 . . . . 0.0 109.474 -173.148 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.55 ' HB3' HD12 ' A' ' 10' ' ' ILE . 72.6 m-85 -121.61 114.73 21.59 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.54 HD23 ' HD2' ' A' ' 11' ' ' ARG . 23.6 tp -70.55 93.62 0.92 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 170.273 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 73.5 t -70.73 105.84 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 124.659 1.184 . . . . 0.0 110.571 -175.882 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 21.0 tptm -78.63 101.06 7.27 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 172.891 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.504 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 74.1 m95 -69.09 141.23 54.78 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 173.753 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -76.65 -39.56 51.86 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.95 -47.96 35.89 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.212 178.339 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.504 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.9 m95 -87.24 136.31 33.76 Favored Pre-proline 0 N--CA 1.479 0.994 0 C-N-CA 123.455 0.702 . . . . 0.0 110.491 -177.987 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -60.42 164.05 13.83 Favored 'Trans proline' 0 CA--C 1.569 2.262 0 C-N-CA 123.081 2.521 . . . . 0.0 112.034 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.53 -19.33 13.41 Favored 'Trans proline' 0 C--N 1.39 2.744 0 C-N-CA 124.059 3.173 . . . . 0.0 115.562 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -71.58 -27.51 63.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.634 0.374 . . . . 0.0 111.991 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.424 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 67.6 m-85 -97.19 12.39 33.0 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.425 0.69 . . . . 0.0 111.857 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -64.77 122.77 17.67 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 173.841 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.7 p -101.55 128.8 47.63 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.877 0.871 . . . . 0.0 111.005 -173.716 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -68.8 83.49 0.3 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 171.811 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 41' ' ' HIS . 29.0 mm-40 -106.85 116.82 58.07 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.994 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.1 174.96 5.23 Favored 'Trans proline' 0 C--N 1.362 1.243 0 C-N-CA 122.064 1.843 . . . . 0.0 111.421 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -56.84 -19.07 15.44 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.495 1.118 . . . . 0.0 112.858 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.73 -22.89 62.68 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.127 1.371 . . . . 0.0 112.078 173.608 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.498 ' HB2' ' HB3' ' A' ' 37' ' ' GLU . 66.8 m-70 -117.04 -16.47 10.48 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.149 0.98 . . . . 0.0 112.176 -174.094 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mm -82.26 140.92 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 122.905 0.482 . . . . 0.0 110.626 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.5 mt -87.91 -70.73 0.61 Allowed 'General case' 0 C--N 1.351 0.655 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.74 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -72.73 126.63 90.59 Favored Pre-proline 0 CA--C 1.557 1.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -80.13 -17.6 10.45 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.865 2.377 . . . . 0.0 113.828 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.643 ' HA ' ' HG2' ' A' ' 49' ' ' MET . 87.1 mtm180 -69.82 -16.38 63.26 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.247 0.619 . . . . 0.0 111.887 -173.866 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.464 HD11 HG13 ' A' ' 7' ' ' VAL . 4.3 mm? -58.02 -53.75 54.68 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.346 0.658 . . . . 0.0 110.457 172.263 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.7 t -70.69 -53.06 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 114.515 -1.221 . . . . 0.0 109.85 -171.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.643 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 25.6 ptm -59.18 -33.34 70.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.722 0.639 . . . . 0.0 112.086 -174.998 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.97 -49.56 74.24 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -66.13 -30.95 71.54 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.004 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -74.97 -18.88 60.31 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.788 0.835 . . . . 0.0 111.586 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -77.12 -10.59 59.49 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.94 0.496 . . . . 0.0 111.544 173.666 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.15 175.08 9.81 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.055 0.542 . . . . 0.0 111.174 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -131.75 100.42 5.1 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 166.602 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 123.506 0.722 . . . . 0.0 111.014 -174.133 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 . . . . . 0 N--CA 1.476 0.837 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.47 167.39 21.99 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 122.906 0.483 . . . . 0.0 110.397 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.589 ' HB1' ' HA ' ' A' ' 8' ' ' GLU . . . -91.22 19.64 5.74 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.579 0.752 . . . . 0.0 111.771 -179.269 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 18.6 m -87.08 67.62 9.77 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 122.277 1.037 . . . . 0.0 110.579 -177.964 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.07 161.81 36.73 Favored 'General case' 0 C--O 1.243 0.76 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 171.903 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -127.55 123.8 36.68 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 111.297 -176.757 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.92 168.42 10.31 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 167.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -141.53 166.22 25.36 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -176.007 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.778 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.841 175.908 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 25.0 p 178.1 147.47 0.15 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.33 1.052 . . . . 0.0 110.357 -175.275 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.11 157.12 66.37 Favored Pre-proline 0 N--CA 1.48 1.071 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 167.68 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.75 108.92 0.27 Allowed 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 122.323 2.015 . . . . 0.0 110.767 170.503 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.85 -22.99 67.08 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.07 0.948 . . . . 0.0 113.034 -168.245 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.1 m 62.08 33.53 17.02 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 122.585 1.184 . . . . 0.0 110.453 176.173 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.38 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.961 -178.138 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.528 ' HA2' ' HA ' ' B' ' 28' ' ' SER . . . . . . . . 0 N--CA 1.477 1.396 0 N-CA-C 111.943 -0.463 . . . . 0.0 111.943 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -95.79 -55.34 3.03 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.372 0.669 . . . . 0.0 110.322 -173.719 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -115.97 153.28 31.91 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 122.92 0.488 . . . . 0.0 110.538 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 47.9 t -133.85 128.24 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 167.785 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.568 ' HE2' HM33 ' B' ' 27' ' ' M3L . 63.6 m-85 -138.07 166.8 23.21 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.224 0.61 . . . . 0.0 109.84 175.142 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.92 151.38 44.76 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.42 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.485 HG13 HD11 ' A' ' 47' ' ' LEU . 2.5 p -138.49 133.41 42.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 C-N-CA 124.097 0.959 . . . . 0.0 109.479 -176.898 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' B' ' 21' ' ' ALA . 10.7 tp10 -72.64 -50.5 24.77 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.91 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 p -174.25 175.36 2.68 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 124.336 1.054 . . . . 0.0 110.047 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.592 HD12 ' HB3' ' A' ' 22' ' ' TYR . 40.2 mm -78.67 116.9 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 168.226 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -64.61 -56.24 15.14 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 124.306 1.042 . . . . 0.0 109.179 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -141.26 165.94 26.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.11 0.964 . . . . 0.0 110.195 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -146.62 139.19 25.12 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.652 0.781 . . . . 0.0 109.71 -173.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -157.34 170.9 21.42 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.866 1.266 . . . . 0.0 108.49 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 t -129.16 132.88 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 118.665 0.666 . . . . 0.0 109.627 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.417 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 66.4 ttt180 -144.15 122.89 12.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.546 0.739 . . . . 0.0 109.231 -177.955 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.417 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 93.1 mttt 65.24 26.63 12.25 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.752 1.221 . . . . 0.0 111.76 176.746 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.85 -10.8 72.54 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.866 -176.916 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -98.79 115.12 28.08 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.844 0.858 . . . . 0.0 110.471 -176.008 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.4 112.09 14.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -92.23 143.44 26.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.187 0.995 . . . . 0.0 109.679 -175.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.592 ' HB3' HD12 ' A' ' 10' ' ' ILE . 66.8 m-85 -129.96 117.54 20.25 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.0 tp -68.63 89.09 0.36 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 172.243 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.557 HG21 HD11 ' A' ' 42' ' ' ILE . 97.4 t -74.65 107.89 5.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.627 0 C-N-CA 123.594 0.758 . . . . 0.0 110.526 -174.477 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -79.45 100.25 7.59 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.441 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.543 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 80.1 m95 -68.19 127.42 32.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.071 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -64.8 -41.18 96.01 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.985 0.914 . . . . 0.0 112.027 -166.136 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.43 18.81 52.97 Favored Glycine 0 N--CA 1.474 1.231 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.578 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.543 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 87.9 m95 -129.79 140.7 39.43 Favored Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 123.798 0.839 . . . . 0.0 109.861 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.435 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 80.1 Cg_exo -51.91 154.33 10.24 Favored 'Trans proline' 0 C--N 1.382 2.315 0 C-N-CA 123.544 2.829 . . . . 0.0 113.989 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -53.65 -24.19 28.75 Favored 'Trans proline' 0 C--N 1.386 2.514 0 C-N-CA 123.949 3.1 . . . . 0.0 114.841 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.435 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 58.6 pttt -66.42 -28.55 68.7 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 122.675 0.39 . . . . 0.0 111.471 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -88.94 2.38 53.95 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.352 0.661 . . . . 0.0 112.15 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.7 p -67.3 117.32 9.15 Favored 'General case' 0 C--N 1.356 0.883 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.504 HG21 HM12 ' B' ' 27' ' ' M3L . 20.3 p -108.22 136.42 47.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.859 0.864 . . . . 0.0 110.506 -173.907 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -69.89 80.62 0.46 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.413 0.685 . . . . 0.0 110.173 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.503 ' HB2' HD11 ' A' ' 42' ' ' ILE . 15.4 mm-40 -94.67 116.0 65.92 Favored Pre-proline 0 C--O 1.239 0.508 0 C-N-CA 123.63 0.772 . . . . 0.0 109.025 177.417 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -66.0 172.19 8.91 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 121.992 1.795 . . . . 0.0 112.19 172.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -54.13 -28.67 41.3 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.687 1.195 . . . . 0.0 112.355 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -59.66 -34.81 73.32 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.185 1.394 . . . . 0.0 111.709 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.735 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 11.4 m170 -85.05 -31.55 23.35 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.507 -173.763 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.557 HD11 HG21 ' A' ' 24' ' ' VAL . 36.9 mm -86.62 144.49 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 124.061 0.944 . . . . 0.0 111.666 -167.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.07 -72.14 0.38 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.543 0.737 . . . . 0.0 110.513 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.33 117.75 64.31 Favored Pre-proline 0 CA--C 1.557 1.227 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -78.3 -15.91 14.0 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.427 2.085 . . . . 0.0 112.893 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -72.76 -12.45 61.01 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 111.981 -173.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.485 HD11 HG13 ' A' ' 7' ' ' VAL . 3.1 mm? -50.95 -45.06 60.55 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 123.048 0.539 . . . . 0.0 110.885 168.163 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.4 t -61.24 -49.88 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.387 -176.88 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -68.83 -37.24 79.04 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.089 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.53 93.87 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.833 0.853 . . . . 0.0 111.017 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.473 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 18.8 t80 -61.92 -53.29 57.82 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.857 0.863 . . . . 0.0 110.667 174.716 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.8 -36.85 76.03 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.4 -170.674 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.1 -32.76 74.44 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 118.097 0.408 . . . . 0.0 111.296 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -71.45 -26.16 62.6 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.685 0.794 . . . . 0.0 110.944 175.917 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -92.84 -17.0 24.63 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.808 0.843 . . . . 0.0 111.464 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 . . . . . 0 N--CA 1.48 1.058 0 C-N-CA 124.04 0.936 . . . . 0.0 108.579 176.879 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 90.9 mt -79.52 118.87 21.78 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.396 0.679 . . . . 0.0 109.53 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 8' ' ' GLU . . . -81.74 131.38 35.26 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.219 0.608 . . . . 0.0 111.467 -174.017 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 14.0 m -109.21 38.74 2.22 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 122.833 1.301 . . . . 0.0 108.176 172.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 23' ' ' LYS . . . . . 0.44 ' HB3' HD21 ' A' ' 47' ' ' LEU . 1.3 mptm? -67.9 163.6 21.65 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-N 113.672 -1.604 . . . . 0.0 111.035 174.865 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.37 112.81 22.03 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.138 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.542 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.41 168.67 10.25 Favored 'General case' 0 C--O 1.245 0.841 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 169.655 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.445 ' NH2' ' HA3' ' A' ' 1' ' ' GLY . 17.7 ttt180 -150.54 149.3 29.76 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 122.92 0.488 . . . . 0.0 110.101 -169.525 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.568 HM33 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.243 0.732 0 C-N-CA 124.184 0.994 . . . . 0.0 109.205 176.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.735 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 31.5 m -83.45 79.03 9.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.995 0.426 . . . . 0.0 110.566 173.56 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.27 119.35 75.97 Favored Pre-proline 0 C--O 1.245 0.849 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.171 172.646 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -58.14 103.28 0.15 Allowed 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.245 1.964 . . . . 0.0 110.748 172.61 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.78 75.51 2.1 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 123.836 0.854 . . . . 0.0 111.222 -173.584 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 7.1 t -91.88 142.86 27.1 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.462 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.336 0 CA-C-O 118.808 -0.995 . . . . 0.0 111.824 -179.11 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.959 0 N-CA-C 112.652 -0.179 . . . . 0.0 112.652 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' B' ' 27' ' ' M3L . 4.1 mp0 -101.78 91.03 4.21 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.778 0.831 . . . . 0.0 109.137 -177.647 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.498 ' HB2' ' HD3' ' B' ' 27' ' ' M3L . 1.8 mp0 -82.96 119.16 24.08 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.004 0.521 . . . . 0.0 110.772 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.8 t -103.05 127.71 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.348 1.059 . . . . 0.0 108.729 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.456 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 76.1 m-85 -138.87 158.04 44.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.368 0.667 . . . . 0.0 109.868 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.93 101.11 5.06 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 171.437 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -72.14 139.57 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.186 0.994 . . . . 0.0 110.996 -175.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 28.4 tt0 -73.11 -51.79 16.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.62 0.768 . . . . 0.0 109.907 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.9 p -175.07 -175.84 0.89 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.054 1.341 . . . . 0.0 109.403 175.628 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.503 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 42.9 mm -97.65 117.65 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 169.796 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.5 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.1 tmt_? -74.1 -58.07 3.54 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.5 1.12 . . . . 0.0 109.594 -177.72 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.3 mttm -136.72 178.83 6.77 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.8 0.84 . . . . 0.0 111.011 -176.182 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.443 ' HE3' HG11 ' A' ' 20' ' ' VAL . 86.1 tttt -158.42 147.57 19.17 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.51 1.124 . . . . 0.0 108.917 -175.557 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -164.03 143.81 8.03 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.995 0.918 . . . . 0.0 109.369 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.1 p -88.05 141.65 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.483 ' HE ' ' HA ' ' A' ' 16' ' ' ARG . 2.3 tpm_? -142.31 99.17 3.45 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.843 0.857 . . . . 0.0 108.747 -174.812 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 60.39 29.81 19.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.382 1.073 . . . . 0.0 111.487 -176.773 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.82 -17.35 58.85 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-N 116.264 -0.426 . . . . 0.0 113.417 -175.563 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.49 111.59 22.0 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.266 0.626 . . . . 0.0 110.067 177.889 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.443 HG11 ' HE3' ' A' ' 13' ' ' LYS . 50.6 t -85.44 111.39 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.006 -175.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.421 ' HB3' ' HB3' ' A' ' 36' ' ' TRP . 34.5 mm-40 -94.17 140.63 29.52 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.3 1.44 . . . . 0.0 109.411 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -120.12 120.55 36.55 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.445 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 43.7 tp -68.82 86.86 0.34 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 172.094 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.513 HG21 HD11 ' A' ' 42' ' ' ILE . 88.4 t -73.18 106.08 2.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.187 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -74.54 100.54 3.91 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.69 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.7 m95 -73.24 145.03 46.48 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 3.8 ttmp? -71.24 -39.82 71.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 122.757 0.423 . . . . 0.0 111.836 -173.54 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.78 -10.97 74.94 Favored Glycine 0 C--N 1.346 1.112 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.403 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 23.3 m95 -110.24 141.67 24.37 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.496 0.718 . . . . 0.0 109.468 -176.916 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.73 163.65 36.72 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.414 2.076 . . . . 0.0 111.249 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.75 -26.28 72.58 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.045 2.497 . . . . 0.0 113.704 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.34 -38.71 88.27 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.253 0.621 . . . . 0.0 110.881 176.349 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.435 ' HB3' ' HE3' ' A' ' 29' ' ' TRP . 39.6 m-85 -99.05 0.45 43.75 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.463 0.705 . . . . 0.0 111.917 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.0 m -70.0 129.48 39.57 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.349 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.611 HG21 HM12 ' B' ' 27' ' ' M3L . 26.4 p -109.61 148.94 30.43 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.16 0.584 . . . . 0.0 111.833 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 36' ' ' TRP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 87.5 m95 -77.01 86.81 3.52 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.039 0.935 . . . . 0.0 110.402 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.459 ' HB2' HG21 ' A' ' 24' ' ' VAL . 38.8 mm-40 -97.9 118.44 63.89 Favored Pre-proline 0 C--O 1.241 0.647 0 C-N-CA 123.63 0.772 . . . . 0.0 109.305 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.42 ' O ' HG12 ' A' ' 42' ' ' ILE . 73.9 Cg_endo -73.65 177.46 7.99 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.176 1.917 . . . . 0.0 112.117 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.99 -27.2 51.79 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.745 1.218 . . . . 0.0 112.098 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.93 -28.72 69.73 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.918 1.287 . . . . 0.0 111.914 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.576 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 12.3 m170 -99.72 -28.76 13.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.045 0.938 . . . . 0.0 113.124 -172.803 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.513 HD11 HG21 ' A' ' 24' ' ' VAL . 43.8 mm -79.65 145.75 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 C-N-CA 123.948 0.899 . . . . 0.0 112.84 -169.884 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 mt -78.43 -64.34 1.19 Allowed 'General case' 0 C--N 1.358 0.974 0 C-N-CA 123.946 0.898 . . . . 0.0 110.852 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.93 117.46 65.12 Favored Pre-proline 0 N--CA 1.485 1.313 0 CA-C-O 119.412 -0.327 . . . . 0.0 110.628 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.99 -35.3 12.2 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.322 2.682 . . . . 0.0 112.6 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.0 mtm180 -70.45 -16.9 62.98 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.524 -174.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.5 tp -57.64 -44.03 85.33 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.537 1.135 . . . . 0.0 111.342 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.6 t -66.37 -41.94 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.543 0.737 . . . . 0.0 110.337 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.2 mtp -63.06 -30.49 71.64 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.397 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -37.01 85.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.678 0.791 . . . . 0.0 110.869 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.503 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.8 t80 -72.09 -35.04 69.11 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.973 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -64.03 -29.49 70.64 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.572 0.349 . . . . 0.0 110.589 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -70.37 -28.68 65.3 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.34 0.656 . . . . 0.0 111.679 173.747 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -62.15 -47.94 82.32 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.027 0.531 . . . . 0.0 110.958 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -91.76 101.81 14.42 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.28 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 . . . . . 0 CA--C 1.558 1.277 0 C-N-CA 124.246 1.018 . . . . 0.0 110.044 179.708 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 . . . . . 0 N--CA 1.494 1.727 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.57 104.06 4.4 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 123.941 0.896 . . . . 0.0 108.717 174.88 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.05 120.45 19.64 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 122.328 0.251 . . . . 0.0 110.339 177.694 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 24.2 p -84.49 -1.32 55.55 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.287 0.635 . . . . 0.0 110.434 168.513 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -57.05 153.8 10.85 Favored 'General case' 0 C--N 1.35 0.604 0 C-N-CA 124.786 1.234 . . . . 0.0 111.839 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.53 127.9 54.34 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.161 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -110.78 162.19 15.03 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 169.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 -142.62 159.86 41.43 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 123.09 0.556 . . . . 0.0 110.025 -172.824 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.611 HM12 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 124.426 1.09 . . . . 0.0 109.705 173.126 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.576 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 17.8 m -57.1 98.42 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 123.006 0.191 . . . . 0.0 110.554 175.272 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.27 115.43 26.08 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 123.16 0.584 . . . . 0.0 110.268 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -77.41 67.55 7.73 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 122.991 2.461 . . . . 0.0 111.207 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -132.8 139.91 47.74 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.384 1.074 . . . . 0.0 110.028 -172.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 35.9 p -79.44 85.98 5.17 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.346 0.658 . . . . 0.0 109.847 177.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.191 0 CA-C-O 119.022 -0.877 . . . . 0.0 112.376 -178.569 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.436 0 N-CA-C 112.33 -0.308 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -107.39 -80.94 0.56 Allowed 'General case' 0 C--N 1.351 0.665 0 C-N-CA 123.332 0.653 . . . . 0.0 110.297 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -152.17 157.51 41.61 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.562 0.745 . . . . 0.0 111.789 -168.932 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 69.1 t -128.31 129.36 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 125.378 1.471 . . . . 0.0 107.878 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.549 ' HE2' HM33 ' B' ' 27' ' ' M3L . 63.7 m-85 -141.7 162.59 35.11 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.367 0.667 . . . . 0.0 110.569 177.397 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.98 131.29 44.84 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.271 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.486 HG13 HD11 ' A' ' 47' ' ' LEU . 2.2 p -123.14 133.89 67.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 124.863 1.265 . . . . 0.0 108.55 -174.267 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -80.46 -40.39 26.32 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.706 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.3 p -175.91 179.46 1.33 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.788 0.835 . . . . 0.0 110.289 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.413 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.9 mm -89.73 122.78 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 165.483 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.531 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -80.89 -51.2 8.83 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.442 0.697 . . . . 0.0 109.371 -178.27 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.446 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 27.2 mtpp -137.11 171.77 14.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.621 0.768 . . . . 0.0 111.104 -175.975 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -155.24 143.25 20.04 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.538 0.735 . . . . 0.0 109.953 -174.016 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -160.91 144.43 13.25 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.701 0.8 . . . . 0.0 109.614 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.61 115.54 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -121.0 119.8 33.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.347 1.059 . . . . 0.0 109.41 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 63.51 25.65 14.52 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.175 0.99 . . . . 0.0 112.146 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.0 -12.78 52.43 Favored Glycine 0 N--CA 1.475 1.244 0 CA-C-N 116.227 -0.442 . . . . 0.0 113.053 -174.463 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.476 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 1.3 mmmp? -83.67 111.64 19.32 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.494 1.118 . . . . 0.0 108.546 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 t -82.09 106.23 12.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -97.3 142.9 28.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.459 1.104 . . . . 0.0 109.61 -174.763 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.413 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.6 m-85 -127.25 126.22 42.32 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.601 0.76 . . . . 0.0 109.693 -176.691 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.475 HD23 ' HB3' ' A' ' 11' ' ' ARG . 50.0 tp -67.7 94.17 0.42 Allowed 'General case' 0 C--N 1.349 0.583 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.343 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.523 HG21 HD11 ' A' ' 42' ' ' ILE . 90.1 t -77.1 104.01 4.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.879 -178.326 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 26.6 tptp -79.97 99.99 7.89 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -177.269 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.6 m95 -67.05 136.43 55.22 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.981 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -58.7 -33.75 70.53 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.037 0.535 . . . . 0.0 111.024 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.54 -55.43 2.71 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.495 176.075 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 98.4 m95 -77.97 129.57 75.55 Favored Pre-proline 0 CA--C 1.563 1.443 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -170.567 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.49 160.13 1.78 Allowed 'Trans proline' 0 C--N 1.387 2.603 0 C-N-CA 124.673 3.582 . . . . 0.0 113.465 172.742 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.463 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 32.1 Cg_endo -60.55 -17.8 50.67 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 123.132 2.554 . . . . 0.0 114.415 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.7 pttt -83.13 -32.65 26.56 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.639 0.376 . . . . 0.0 111.214 174.172 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -87.22 -8.67 56.59 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.108 0.563 . . . . 0.0 110.578 173.994 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 68.0 m -73.44 133.25 43.65 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 171.503 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.8 p -99.44 133.36 43.87 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.558 0.743 . . . . 0.0 111.075 -168.759 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -75.02 83.54 2.26 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.263 0.625 . . . . 0.0 110.106 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB2' HG21 ' A' ' 24' ' ' VAL . 44.4 mm-40 -104.85 130.59 22.91 Favored Pre-proline 0 N--CA 1.468 0.444 0 C-N-CA 123.262 0.625 . . . . 0.0 110.448 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.411 ' O ' HG12 ' A' ' 42' ' ' ILE . 40.0 Cg_endo -64.54 164.46 23.55 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 122.003 1.802 . . . . 0.0 112.037 170.644 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -52.86 -30.51 34.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.46 1.104 . . . . 0.0 111.701 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.9 -34.59 78.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.212 1.405 . . . . 0.0 111.468 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.0 m170 -85.1 -9.94 57.37 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.961 0.904 . . . . 0.0 112.793 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.523 HD11 HG21 ' A' ' 24' ' ' VAL . 38.8 mm -90.48 155.94 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 123.943 0.897 . . . . 0.0 110.959 -176.596 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -84.13 -77.67 0.26 Allowed 'General case' 0 C--N 1.353 0.748 0 C-N-CA 123.128 0.571 . . . . 0.0 109.98 167.656 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -75.14 127.92 85.72 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-O 119.673 -0.203 . . . . 0.0 111.168 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.26 -31.34 22.96 Favored 'Trans proline' 0 C--N 1.375 1.937 0 C-N-CA 122.547 2.164 . . . . 0.0 113.802 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.2 -14.42 37.74 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.66 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.486 HD11 HG13 ' A' ' 7' ' ' VAL . 3.5 mm? -60.3 -50.59 73.03 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 118.749 0.704 . . . . 0.0 110.012 170.143 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 74.1 t -67.51 -54.01 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.882 178.364 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.418 ' N ' ' SD ' ' A' ' 49' ' ' MET . 0.4 OUTLIER -58.97 -45.48 90.43 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.746 0.819 . . . . 0.0 112.09 -173.369 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.12 87.3 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.281 0.363 . . . . 0.0 111.175 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.45 -37.34 86.6 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.061 0.945 . . . . 0.0 110.747 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 31.0 mm-40 -69.95 -23.13 63.14 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.282 0.633 . . . . 0.0 111.081 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -96.3 5.79 50.2 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.27 1.028 . . . . 0.0 112.227 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -78.47 165.55 23.64 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 120.87 0.367 . . . . 0.0 111.384 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.18 134.1 56.67 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.115 0.966 . . . . 0.0 112.178 -173.237 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 . . . . . 0 C--O 1.248 1.003 0 C-N-CA 123.964 0.906 . . . . 0.0 110.242 -179.598 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 121.042 0.448 . . . . 0.0 110.002 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 69.8 mt -92.55 159.95 15.26 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.354 1.061 . . . . 0.0 109.268 175.458 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.04 153.27 26.24 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.082 0.553 . . . . 0.0 110.398 177.427 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.7 p -121.86 5.05 9.94 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.472 0.709 . . . . 0.0 110.452 173.833 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -82.46 156.89 23.86 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 123.221 0.609 . . . . 0.0 110.756 -171.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -112.77 134.06 54.48 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.714 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.463 ' HB2' HG11 ' A' ' 7' ' ' VAL . . . -109.19 -175.69 2.83 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 171.566 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -150.67 155.69 39.86 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -170.36 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.549 HM33 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 N--CA 1.475 0.786 0 C-N-CA 123.689 0.795 . . . . 0.0 112.026 -175.674 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 34.9 p -167.88 157.88 10.3 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 122.053 -0.405 . . . . 0.0 111.416 -168.75 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.82 166.19 34.55 Favored Pre-proline 0 CA--C 1.558 1.268 0 C-N-CA 123.464 0.706 . . . . 0.0 110.863 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_exo -46.11 100.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.387 2.574 0 C-N-CA 123.244 2.629 . . . . 0.0 113.1 173.318 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.43 104.63 4.49 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.073 0.949 . . . . 0.0 111.548 -170.938 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.3 m -136.1 56.0 1.84 Allowed 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.616 -179.516 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.967 0 N-CA-C 111.826 -0.51 . . . . 0.0 111.826 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -68.24 93.0 0.43 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.271 0.628 . . . . 0.0 111.392 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -78.84 91.54 4.76 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.286 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -102.01 136.1 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.012 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -138.58 153.85 48.69 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.895 0.878 . . . . 0.0 109.014 170.823 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.66 134.38 47.49 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 173.734 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -120.63 141.78 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.211 1.005 . . . . 0.0 110.164 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -73.65 -60.27 2.33 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.579 174.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.425 ' HB3' HD22 ' B' ' 20' ' ' LEU . 30.3 p -170.91 -174.61 1.58 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.425 1.09 . . . . 0.0 109.548 -175.349 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.523 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 50.8 mm -97.87 117.86 43.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.018 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.24 -50.18 35.56 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.048 0.939 . . . . 0.0 110.529 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -140.72 170.8 15.09 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.475 0.71 . . . . 0.0 110.634 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -155.77 148.5 24.1 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.894 0.878 . . . . 0.0 108.635 -175.028 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.468 ' NH1' ' HD2' ' A' ' 16' ' ' ARG . 2.2 ptm180 -159.92 154.67 24.32 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.59 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -104.44 137.4 33.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 166.596 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.468 ' HD2' ' NH1' ' A' ' 14' ' ' ARG . 75.4 ttt180 -150.52 98.6 2.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -168.869 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 65.55 25.42 11.75 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.549 0.74 . . . . 0.0 111.115 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.71 -16.16 59.91 Favored Glycine 0 C--N 1.355 1.595 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.817 -173.892 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -84.24 111.32 19.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.9 t -86.95 108.04 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -97.05 144.43 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.126 0.57 . . . . 0.0 109.605 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.457 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.3 m-85 -123.45 116.82 23.86 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.7 tp -68.09 88.02 0.28 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 170.742 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.85 106.98 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.938 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -76.98 96.97 4.5 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.9 m95 -68.69 145.53 53.78 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -80.62 -30.35 36.75 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.6 -10.65 84.97 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 115.897 -0.592 . . . . 0.0 113.669 177.032 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.3 m95 -131.15 132.36 23.7 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 110.199 -177.208 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.42 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 32.4 Cg_endo -62.94 170.11 7.92 Favored 'Trans proline' 0 CA--C 1.572 2.395 0 C-N-CA 122.853 2.369 . . . . 0.0 112.483 175.168 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.62 -24.2 69.21 Favored 'Trans proline' 0 C--N 1.394 2.947 0 C-N-CA 122.793 2.328 . . . . 0.0 114.016 -174.89 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.86 -28.24 65.5 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.389 0.676 . . . . 0.0 112.512 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.55 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 80.2 m-85 -96.84 -3.59 41.83 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.17 0.588 . . . . 0.0 111.579 175.254 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.3 m -66.79 132.86 48.95 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.677 0.391 . . . . 0.0 109.988 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.496 HG21 HM12 ' B' ' 27' ' ' M3L . 30.1 p -122.79 150.37 42.9 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.651 -169.878 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -80.55 83.17 6.4 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.622 0.769 . . . . 0.0 110.521 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -95.17 121.22 62.75 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.57 165.39 29.45 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 121.853 1.702 . . . . 0.0 111.088 172.591 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -53.8 -27.25 28.12 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.078 0.951 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -60.3 -40.95 92.33 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.796 1.239 . . . . 0.0 110.992 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 17.3 m170 -81.45 -29.76 33.68 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.426 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.92 143.95 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.473 0.709 . . . . 0.0 111.348 -175.033 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.412 ' HB3' ' O ' ' B' ' 24' ' ' ALA . 5.1 tt -82.69 -77.53 0.23 Allowed 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.65 122.42 85.76 Favored Pre-proline 0 CA--C 1.556 1.186 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.496 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.33 -15.54 22.48 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 122.779 2.319 . . . . 0.0 114.107 -175.426 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 50.0 mtm180 -71.02 -12.14 61.36 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.25 -42.11 80.9 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 118.134 0.425 . . . . 0.0 111.127 170.194 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.508 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 48.0 t -62.12 -50.33 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.122 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.402 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 25.2 mmt -57.48 -40.16 77.97 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.129 0.972 . . . . 0.0 111.66 -177.986 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.549 ' HB1' HD23 ' B' ' 20' ' ' LEU . . . -65.17 -33.76 76.77 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.054 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.523 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 83.1 t80 -74.83 -37.67 62.23 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.429 0.692 . . . . 0.0 110.485 174.927 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 18.8 mm-40 -67.51 -20.49 65.45 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.792 0.437 . . . . 0.0 110.709 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 49' ' ' MET . 22.3 mm-40 -66.09 -19.52 65.87 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.699 0.799 . . . . 0.0 112.267 174.805 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.61 -19.73 63.63 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.872 0.469 . . . . 0.0 110.46 173.688 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -112.35 176.55 4.97 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.478 1.111 . . . . 0.0 109.542 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 . . . . . 0 C--O 1.251 1.178 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.81 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 8.6 tp-100 . . . . . 0 N--CA 1.487 1.412 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 20' ' ' LEU . . . . . 0.549 HD23 ' HB1' ' A' ' 50' ' ' ALA . 5.0 mp -87.86 154.24 20.69 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.139 0.576 . . . . 0.0 109.989 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.31 112.25 2.99 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 173.539 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 11.2 m -69.53 96.32 0.91 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.554 0.692 . . . . 0.0 110.804 -173.007 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -90.29 -176.48 4.83 Favored 'General case' 0 C--O 1.246 0.896 0 CA-C-N 114.978 -1.01 . . . . 0.0 108.685 172.862 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 24' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' A' ' 43' ' ' LEU . . . -121.28 125.46 47.11 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -94.6 -179.25 4.82 Favored 'General case' 0 C--O 1.244 0.794 0 N-CA-C 107.921 -1.141 . . . . 0.0 107.921 169.113 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 -156.11 156.94 35.16 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -169.306 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.496 HM12 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 N--CA 1.475 0.778 0 C-N-CA 123.631 0.772 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 19.1 m -148.52 150.72 33.89 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.347 0.259 . . . . 0.0 111.466 -168.109 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.19 149.35 84.67 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.199 0.6 . . . . 0.0 110.784 176.449 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.44 -28.28 70.96 Favored 'Trans proline' 0 C--N 1.376 2.011 0 C-N-CA 122.426 2.084 . . . . 0.0 112.651 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . 78.17 -45.18 0.41 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.58 1.552 . . . . 0.0 114.379 170.143 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.3 m -65.12 -34.32 78.13 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.365 0.666 . . . . 0.0 111.466 -177.576 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.31 0 CA-C-O 118.667 -1.074 . . . . 0.0 111.565 178.999 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.084 0 N-CA-C 112.561 -0.216 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -84.99 92.28 8.29 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.623 0.769 . . . . 0.0 109.464 -179.391 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -73.53 83.79 1.52 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.079 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.8 t -124.99 122.51 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -133.3 160.97 35.76 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 123.31 0.644 . . . . 0.0 109.967 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.02 136.3 55.06 Favored 'General case' 0 C--O 1.248 1.017 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.045 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 p -116.34 145.27 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.82 0.848 . . . . 0.0 110.178 -174.358 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.633 ' HG3' HD12 ' B' ' 20' ' ' LEU . 45.8 tt0 -78.87 -56.17 4.6 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.803 0.841 . . . . 0.0 109.748 176.852 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.0 p -175.19 -171.53 0.52 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.491 1.116 . . . . 0.0 110.2 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.547 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -99.68 117.97 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 170.183 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -52.17 14.08 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.509 1.124 . . . . 0.0 110.221 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -139.72 169.41 17.78 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.418 0.687 . . . . 0.0 111.353 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -155.77 137.67 14.44 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.313 1.045 . . . . 0.0 108.781 -177.15 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -160.94 137.63 8.7 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.98 0.912 . . . . 0.0 108.935 177.883 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.46 129.85 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -136.61 113.76 10.64 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? 62.21 33.41 16.77 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 124.547 1.139 . . . . 0.0 109.459 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.84 -18.94 18.2 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.749 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -84.54 111.01 19.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.51 0.724 . . . . 0.0 109.303 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.9 t -78.59 110.77 14.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -93.98 138.76 31.73 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.61 1.164 . . . . 0.0 109.894 -171.329 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.547 ' HB3' HD12 ' A' ' 10' ' ' ILE . 79.1 m-85 -125.54 116.42 21.74 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.432 0.693 . . . . 0.0 109.434 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.8 tp -69.54 91.52 0.59 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 170.149 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.624 HG21 HD11 ' A' ' 42' ' ' ILE . 73.1 t -73.43 106.18 3.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.174 -175.789 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.534 ' HE2' ' HD3' ' A' ' 31' ' ' PRO . 25.4 tptp -76.2 102.4 5.78 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 174.274 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -73.21 154.68 40.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.087 0.555 . . . . 0.0 110.894 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -75.75 -44.28 42.54 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 171.159 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.48 -41.42 30.12 Favored Glycine 0 C--N 1.352 1.462 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.194 -178.168 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -100.91 143.19 26.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.231 0.612 . . . . 0.0 111.166 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.37 172.86 14.11 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 123.5 2.8 . . . . 0.0 112.415 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' PRO . . . . . 0.534 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 30.0 Cg_endo -61.21 -29.23 86.25 Favored 'Trans proline' 0 C--N 1.394 2.921 0 C-N-CA 122.963 2.442 . . . . 0.0 113.401 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -67.5 -30.05 69.63 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.296 0.638 . . . . 0.0 111.401 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 13.88 29.27 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.629 0.771 . . . . 0.0 111.614 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.9 m -74.43 136.03 42.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 169.637 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.8 p -114.84 138.16 51.1 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.492 0.717 . . . . 0.0 112.046 -168.44 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -74.88 87.76 2.29 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.542 0.737 . . . . 0.0 109.899 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HB2' HD11 ' A' ' 42' ' ' ILE . 42.9 mm-40 -108.87 116.61 55.48 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 123.894 0.878 . . . . 0.0 109.905 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 37' ' ' GLU . 38.4 Cg_endo -63.25 169.15 9.83 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 122.551 2.167 . . . . 0.0 112.699 169.795 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -34.81 48.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.306 1.442 . . . . 0.0 113.244 -178.454 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -67.72 -34.37 76.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.893 0.877 . . . . 0.0 110.867 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -78.78 -17.8 55.19 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.625 0.77 . . . . 0.0 111.455 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.624 HD11 HG21 ' A' ' 24' ' ' VAL . 48.9 mm -98.5 148.78 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 124.359 1.064 . . . . 0.0 110.749 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.7 mt -82.1 -70.62 0.53 Allowed 'General case' 0 C--N 1.352 0.675 0 C-N-CA 123.49 0.716 . . . . 0.0 109.919 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -77.01 132.74 70.36 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.902 -171.759 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.435 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 98.1 Cg_endo -78.48 -30.44 3.2 Favored 'Trans proline' 0 CA--C 1.562 1.913 0 C-N-CA 122.52 2.147 . . . . 0.0 115.0 -176.918 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.435 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.32 0.0 OUTLIER -72.61 -9.7 58.91 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.031 . . . . . . . . 4 4 . 1 . 009 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -53.18 -47.91 68.44 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 119.117 0.871 . . . . 0.0 109.911 166.371 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.422 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 63.0 t -60.87 -45.65 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.248 177.463 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.477 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 53.4 mtt -64.09 -30.1 71.19 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.649 0.78 . . . . 0.0 111.305 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.44 78.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 0.0 110.115 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.451 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 46.8 t80 -75.45 -35.12 60.96 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.743 174.389 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.7 mm-40 -69.76 -32.66 71.3 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.583 0.353 . . . . 0.0 111.063 -177.151 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 49' ' ' MET . 22.0 mm-40 -89.5 49.78 1.8 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.344 0.658 . . . . 0.0 111.179 -178.432 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 32.0 mmtp -95.88 124.39 39.88 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 122.998 0.519 . . . . 0.0 110.414 173.401 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -94.56 85.03 4.41 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 166.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 . . . . . 0 CA--C 1.559 1.291 0 C-N-CA 125.48 1.512 . . . . 0.0 110.114 -172.173 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.62 0.724 . . . . 0.0 109.962 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 20' ' ' LEU . . . . . 0.633 HD12 ' HG3' ' A' ' 8' ' ' GLU . 1.8 mm? -115.96 132.25 56.7 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 177.42 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.94 79.23 2.82 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 170.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 35.7 p -76.09 69.85 2.71 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.705 1.202 . . . . 0.0 111.055 -172.243 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -116.94 -172.87 2.29 Favored 'General case' 0 C--O 1.251 1.166 0 C-N-CA 124.18 0.992 . . . . 0.0 108.716 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -110.08 109.21 19.67 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.996 176.815 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.428 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.21 172.15 7.99 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 167.056 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.463 ' HD2' ' O ' ' B' ' 29' ' ' ALA . 18.7 ttp180 -159.77 152.62 21.59 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.516 -165.282 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.628 0 C-N-CA 123.763 0.825 . . . . 0.0 110.047 177.163 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 12.5 t 68.62 0.16 2.52 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 114.093 1.145 . . . . 0.0 114.093 169.271 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.463 ' O ' ' HD2' ' B' ' 26' ' ' ARG . . . -61.89 120.03 53.46 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 123.82 0.848 . . . . 0.0 111.877 -170.768 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.38 -23.39 70.04 Favored 'Trans proline' 0 C--N 1.38 2.227 0 C-N-CA 122.801 2.334 . . . . 0.0 112.401 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -105.76 173.65 6.22 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.031 0.933 . . . . 0.0 111.32 175.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.0 t -154.21 -16.9 0.13 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.629 0.771 . . . . 0.0 111.661 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.97 -0.906 . . . . 0.0 112.322 -175.457 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.522 ' HA ' ' O ' ' B' ' 27' ' ' M3L . 6.1 mp0 -103.59 68.57 0.94 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.47 0.708 . . . . 0.0 110.137 -173.158 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -108.46 142.69 38.47 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 120.988 0.423 . . . . 0.0 110.403 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.9 t -91.83 132.56 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.463 ' CE2' HM33 ' B' ' 27' ' ' M3L . 93.8 m-85 -131.93 163.0 29.31 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 171.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' ALA . . . . . 0.423 ' HB3' ' HE3' ' A' ' 27' ' ' LYS . . . -85.57 116.34 23.81 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.151 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.56 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -98.46 141.17 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.693 1.197 . . . . 0.0 109.28 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 9.7 tp10 -80.26 -49.53 11.47 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.468 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.0 p -171.38 171.79 5.41 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.142 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 49.5 mm -88.27 113.76 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.411 -0.813 . . . . 0.0 108.865 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.405 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.4 tmt_? -72.06 -53.07 13.98 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.546 0.738 . . . . 0.0 109.415 -178.442 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.455 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 65.6 mttm -137.82 173.89 11.16 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.316 0.646 . . . . 0.0 111.249 -176.717 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -157.5 150.38 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.974 0.91 . . . . 0.0 109.322 -174.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.9 ptt85 -168.23 178.75 4.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.622 1.169 . . . . 0.0 109.029 173.299 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.43 132.94 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.871 0.868 . . . . 0.0 108.747 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -142.64 111.76 6.52 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 59.91 42.61 16.02 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.575 1.15 . . . . 0.0 112.383 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.89 -17.32 32.24 Favored Glycine 0 N--CA 1.471 0.985 0 CA-C-N 115.8 -0.636 . . . . 0.0 113.516 176.63 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -84.73 109.91 18.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.1 t -83.92 104.13 11.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 171.006 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.458 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 1.0 OUTLIER -103.28 144.74 30.95 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.824 0.821 . . . . 0.0 110.9 -175.758 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -119.11 124.13 46.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.355 -173.235 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.455 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 55.1 tp -65.57 89.27 0.1 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 170.503 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.456 HG21 ' HB2' ' A' ' 37' ' ' GLU . 74.1 t -76.01 105.57 5.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.173 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -83.99 99.95 10.74 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 53.0 m95 -66.83 134.58 52.4 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -70.42 -15.96 62.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.479 0.312 . . . . 0.0 111.651 -177.694 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.09 10.11 22.74 Favored Glycine 0 C--N 1.351 1.373 0 CA-C-O 119.666 -0.519 . . . . 0.0 113.664 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 81.0 m95 -134.91 148.17 65.86 Favored Pre-proline 0 N--CA 1.498 1.965 0 CA-C-N 117.748 0.774 . . . . 0.0 110.158 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -74.53 165.27 32.05 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.911 2.407 . . . . 0.0 112.062 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.55 -33.87 49.87 Favored 'Trans proline' 0 C--N 1.391 2.775 0 C-N-CA 124.084 3.189 . . . . 0.0 114.646 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -69.43 -30.21 68.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.061 0.544 . . . . 0.0 112.357 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -95.05 -8.41 36.77 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.609 0.764 . . . . 0.0 111.441 175.083 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 59.4 m -75.35 112.23 11.44 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.732 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.488 HG21 HM22 ' B' ' 27' ' ' M3L . 20.4 p -98.36 147.79 24.33 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.64 0.776 . . . . 0.0 111.795 -169.601 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -75.12 89.02 2.46 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.441 0.696 . . . . 0.0 110.226 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.456 ' HB2' HG21 ' A' ' 24' ' ' VAL . 45.8 mm-40 -97.89 119.5 62.16 Favored Pre-proline 0 N--CA 1.469 0.507 0 C-N-CA 123.461 0.704 . . . . 0.0 109.872 178.287 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 47.4 Cg_endo -66.31 167.49 18.38 Favored 'Trans proline' 0 C--N 1.369 1.636 0 C-N-CA 122.07 1.846 . . . . 0.0 112.001 172.605 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.07 -27.0 61.33 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.416 1.087 . . . . 0.0 112.262 176.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.42 -35.33 65.28 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 125.176 1.39 . . . . 0.0 111.717 171.907 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.689 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 16.6 m170 -93.44 -18.15 22.66 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.075 0.95 . . . . 0.0 112.559 -173.92 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.1 mm -86.54 151.57 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.061 0.944 . . . . 0.0 111.352 -171.793 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -96.73 -69.15 0.77 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.749 0.82 . . . . 0.0 110.823 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.15 117.34 53.38 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.42 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 72.0 Cg_endo -74.37 -17.83 20.93 Favored 'Trans proline' 0 C--N 1.369 1.646 0 C-N-CA 122.722 2.281 . . . . 0.0 113.185 -175.939 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.42 ' HD3' ' HG2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -72.22 -12.22 61.07 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.502 0.721 . . . . 0.0 112.481 -177.652 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.405 HD11 HG13 ' A' ' 7' ' ' VAL . 2.2 mm? -52.13 -51.06 60.22 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 118.512 0.597 . . . . 0.0 110.59 169.479 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 59.3 t -61.04 -48.4 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 124.107 0.879 . . . . 0.0 109.694 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.2 mmt -60.44 -38.49 84.31 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.998 -175.118 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.84 -36.41 83.39 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.754 0.821 . . . . 0.0 110.571 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.545 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 81.5 t80 -69.8 -42.72 73.36 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.723 0.809 . . . . 0.0 110.424 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.3 mm-40 -60.69 -37.88 83.14 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.263 0.625 . . . . 0.0 111.285 -177.288 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -65.96 -38.76 89.42 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.884 0.873 . . . . 0.0 112.218 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -92.29 128.28 38.08 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.273 0.558 . . . . 0.0 110.724 -176.17 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -143.79 92.0 2.3 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 . . . . . 0 CA--C 1.555 1.144 0 C-N-CA 123.62 0.768 . . . . 0.0 110.946 -171.572 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 93.4 mt -75.92 105.28 6.87 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.905 0.482 . . . . 0.0 109.707 179.026 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -99.15 33.07 2.49 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.269 1.028 . . . . 0.0 109.83 178.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 22' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 7' ' ' VAL . 34.3 m -61.6 106.92 0.72 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.906 0.882 . . . . 0.0 111.04 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -126.79 -173.19 2.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.518 1.527 . . . . 0.0 109.492 -175.001 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -107.06 106.64 17.25 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.097 0.475 . . . . 0.0 110.761 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -106.75 151.05 25.66 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 162.254 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -134.52 158.95 42.65 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -175.098 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.522 ' O ' ' HA ' ' A' ' 2' ' ' GLU . . . . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 171.932 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.689 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 15.2 m -67.74 77.04 0.2 Allowed 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 121.125 0.488 . . . . 0.0 109.983 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.68 123.05 88.24 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -175.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.18 150.96 45.81 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.093 2.529 . . . . 0.0 112.825 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.77 -34.09 75.25 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.775 0.83 . . . . 0.0 110.789 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 14.1 t -157.85 166.39 32.8 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.535 1.134 . . . . 0.0 109.381 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.122 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 -176.83 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.416 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.437 ' HA ' ' O ' ' B' ' 27' ' ' M3L . 39.6 mt-10 -78.5 102.87 8.08 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.474 0.709 . . . . 0.0 109.664 176.52 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.626 ' HB2' ' HD3' ' B' ' 27' ' ' M3L . 15.0 mm100 -92.87 110.93 22.4 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.241 0.616 . . . . 0.0 110.846 -174.689 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 91.4 t -103.24 116.19 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.565 0.746 . . . . 0.0 109.108 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -130.34 167.03 19.18 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 123.718 0.807 . . . . 0.0 109.402 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.13 122.06 19.44 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.035 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.2 p -97.97 135.94 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.356 0.662 . . . . 0.0 110.177 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -68.19 -52.72 31.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.951 0.901 . . . . 0.0 110.007 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.2 p -177.72 178.0 1.05 Allowed 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.714 -176.831 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.464 HD12 ' HB3' ' A' ' 22' ' ' TYR . 47.9 mm -89.95 114.99 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 168.956 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.558 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -69.82 -51.4 33.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.643 0.777 . . . . 0.0 109.05 -179.393 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -139.26 161.82 36.49 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.301 0.641 . . . . 0.0 111.348 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' LYS . . . . . 0.528 ' HE3' HG11 ' A' ' 20' ' ' VAL . 83.1 tttt -147.69 133.35 18.85 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 108.064 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -159.29 139.39 11.97 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 123.476 0.71 . . . . 0.0 109.396 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.469 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 5.0 p -87.22 121.41 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -134.46 123.49 24.07 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.74 0.816 . . . . 0.0 109.045 -176.558 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 64.24 28.02 13.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.324 1.05 . . . . 0.0 111.854 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.83 -16.97 53.31 Favored Glycine 0 C--N 1.351 1.406 0 CA-C-N 115.484 -0.78 . . . . 0.0 113.258 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -105.46 134.3 48.8 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.82 0.848 . . . . 0.0 110.443 -176.631 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.528 HG11 ' HE3' ' A' ' 13' ' ' LYS . 21.7 t -83.2 116.36 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -174.527 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -95.36 142.03 28.23 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 124.895 1.278 . . . . 0.0 109.741 -178.066 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.464 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.1 m-85 -125.0 120.44 31.56 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.49 0.716 . . . . 0.0 109.75 -178.706 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.512 HD23 ' HD2' ' A' ' 11' ' ' ARG . 27.7 tp -75.22 82.32 2.37 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 169.787 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.469 HG21 HD11 ' A' ' 42' ' ' ILE . 67.1 t -68.65 106.49 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.421 -175.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.3 tptp -84.53 102.82 13.15 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.552 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.597 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.8 m95 -71.5 147.05 48.14 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.247 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -78.44 -36.14 45.87 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.157 0.583 . . . . 0.0 109.903 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.43 -14.45 82.16 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.775 178.595 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.597 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.4 m95 -120.3 148.92 48.51 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 123.253 0.621 . . . . 0.0 111.381 -175.65 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 169.97 20.62 Favored 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.22 2.613 . . . . 0.0 112.2 175.104 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -55.52 -26.43 54.45 Favored 'Trans proline' 0 C--N 1.393 2.893 0 C-N-CA 123.715 2.943 . . . . 0.0 114.999 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -70.41 -9.23 55.8 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.423 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 69.5 m-85 -118.02 14.25 14.06 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.869 0.867 . . . . 0.0 111.409 175.398 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -70.07 116.8 10.86 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.0 p -105.36 137.19 43.56 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.297 0.639 . . . . 0.0 111.878 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -73.87 83.43 1.68 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.111 0.564 . . . . 0.0 109.933 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -110.62 113.14 55.96 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 123.892 0.877 . . . . 0.0 108.863 176.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.429 ' HA ' ' HD2' ' A' ' 22' ' ' TYR . 61.9 Cg_endo -66.8 166.84 21.1 Favored 'Trans proline' 0 C--N 1.365 1.424 0 C-N-CA 122.238 1.959 . . . . 0.0 111.782 173.833 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.21 -23.87 50.75 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.582 1.153 . . . . 0.0 112.807 -177.827 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -62.46 -27.25 68.99 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.106 1.362 . . . . 0.0 111.655 178.246 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.427 ' NE2' ' HA ' ' B' ' 30' ' ' PRO . 11.4 m-70 -113.01 2.84 15.9 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.398 1.079 . . . . 0.0 112.408 -173.243 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.568 HD12 ' HB1' ' B' ' 25' ' ' ALA . 48.8 mm -101.16 148.55 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 124.58 1.152 . . . . 0.0 110.793 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.629 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 53.5 mt -75.68 -78.93 0.1 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 122.989 0.515 . . . . 0.0 110.811 172.458 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -75.05 112.85 19.92 Favored Pre-proline 0 N--CA 1.48 1.07 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -174.0 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -78.21 -13.65 15.29 Favored 'Trans proline' 0 C--N 1.371 1.752 0 C-N-CA 122.872 2.382 . . . . 0.0 112.945 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.56 -12.38 61.34 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.469 0.708 . . . . 0.0 111.41 179.111 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.591 HD22 ' NZ ' ' B' ' 23' ' ' LYS . 3.1 mm? -51.05 -39.16 55.31 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.478 0.311 . . . . 0.0 110.87 167.521 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.5 -51.48 46.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 123.861 0.864 . . . . 0.0 110.882 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 28.3 ptm -64.08 -35.08 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.0 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.11 -34.03 76.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.672 0.789 . . . . 0.0 111.315 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.443 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 74.3 t80 -70.14 -35.36 74.01 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.458 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -85.14 -7.44 59.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.5 0.72 . . . . 0.0 111.965 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 49' ' ' MET . 43.8 mm-40 -72.63 -13.59 61.41 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.71 0.404 . . . . 0.0 109.978 166.67 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.1 165.66 15.6 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 122.991 0.516 . . . . 0.0 109.802 174.214 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -88.48 116.19 26.53 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.868 0.867 . . . . 0.0 111.286 -172.619 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 C--O 1.252 1.227 0 C-N-CA 123.664 0.785 . . . . 0.0 109.755 175.64 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 55.7 tp -136.49 122.29 19.91 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.783 0.833 . . . . 0.0 108.942 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.76 107.13 17.48 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.159 0.584 . . . . 0.0 110.568 -177.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.1 p -91.07 43.04 1.13 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 122.634 1.207 . . . . 0.0 108.629 168.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 23' ' ' LYS . . . . . 0.591 ' NZ ' HD22 ' A' ' 47' ' ' LEU . 6.8 mtpm? -123.57 146.69 47.95 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 126.503 1.921 . . . . 0.0 107.321 -168.407 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -117.96 137.93 52.51 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.107 0.479 . . . . 0.0 111.041 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.568 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -102.9 -167.65 1.42 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.41 171.975 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.629 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 75.9 ttt180 -156.39 143.61 19.02 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -172.582 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.626 ' HD3' ' HB2' ' A' ' 3' ' ' GLN . . . . . . . . 0 C--O 1.242 0.678 0 C-N-CA 123.287 0.635 . . . . 0.0 109.742 173.312 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.419 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 17.2 m -69.82 139.26 53.14 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 170.469 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.17 154.49 30.48 Favored Pre-proline 0 N--CA 1.479 0.986 0 C-N-CA 122.95 0.5 . . . . 0.0 111.107 177.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 30' ' ' PRO . . . . . 0.427 ' HA ' ' NE2' ' A' ' 41' ' ' HIS . 73.0 Cg_exo -52.54 -26.8 30.12 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 122.963 2.442 . . . . 0.0 114.187 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.01 29.2 7.29 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.073 0.949 . . . . 0.0 111.051 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 21.0 m -145.1 136.92 25.57 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.517 0.727 . . . . 0.0 109.737 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.186 0 CA-C-O 118.936 -0.924 . . . . 0.0 112.332 176.537 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.546 0 N-CA-C 111.858 -0.497 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.73 ' HG2' ' H ' ' B' ' 29' ' ' ALA . 37.9 mt-10 -78.76 88.86 4.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.557 0.743 . . . . 0.0 110.349 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -99.39 111.16 23.57 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.334 1.054 . . . . 0.0 110.778 -171.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.403 HG22 ' HD3' ' B' ' 26' ' ' ARG . 20.0 t -88.3 127.19 41.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.464 0.706 . . . . 0.0 109.635 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.427 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 87.7 m-85 -140.58 152.76 45.74 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.291 0.636 . . . . 0.0 110.113 172.659 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.28 117.37 11.75 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 170.074 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -91.39 134.19 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 110.104 -177.625 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.533 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 43.8 tt0 -68.04 -43.68 78.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.424 0.69 . . . . 0.0 110.505 178.232 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 p 177.94 169.51 0.72 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.386 1.074 . . . . 0.0 110.399 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -82.19 113.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.267 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.496 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -73.02 -58.12 3.54 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -177.378 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.422 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 98.3 mttt -134.31 174.29 10.68 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.723 0.809 . . . . 0.0 109.789 -178.547 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -159.85 141.59 12.95 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 123.756 0.822 . . . . 0.0 109.075 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -154.12 159.46 41.48 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.521 0.728 . . . . 0.0 109.755 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 20' ' ' VAL . 40.8 t -104.13 130.25 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 168.779 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -146.73 111.53 5.31 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.3 tptt 65.43 26.35 11.91 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.809 1.243 . . . . 0.0 110.324 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.83 -9.21 46.0 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-N 115.228 -0.896 . . . . 0.0 113.156 -174.279 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.06 110.55 20.71 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 15' ' ' VAL . 47.9 t -84.1 107.07 15.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -174.437 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -98.49 141.42 31.37 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.784 0.834 . . . . 0.0 110.477 -173.022 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.48 ' HB3' HG23 ' A' ' 10' ' ' ILE . 8.6 m-85 -114.23 125.01 53.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.422 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 31.9 tp -70.86 85.17 0.67 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 169.669 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.408 HG21 ' HB2' ' A' ' 37' ' ' GLU . 95.3 t -72.78 104.13 1.92 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.454 -173.215 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.8 tptp -84.0 100.34 11.0 Favored 'General case' 0 C--N 1.345 0.388 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.547 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.1 m95 -69.35 151.03 46.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.623 -179.717 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.533 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 35.7 ttpt -67.88 -46.11 72.6 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 122.981 0.512 . . . . 0.0 111.419 -173.795 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.87 -6.15 72.81 Favored Glycine 0 C--N 1.35 1.34 0 CA-C-N 115.878 -0.601 . . . . 0.0 113.868 -176.877 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.547 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 56.3 m95 -114.85 129.49 24.97 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.404 0.682 . . . . 0.0 110.148 -175.124 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -61.57 165.35 13.64 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.155 2.57 . . . . 0.0 112.35 171.925 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -64.41 -8.95 18.38 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.378 2.718 . . . . 0.0 114.709 -175.506 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -26.84 61.0 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.464 0.306 . . . . 0.0 110.998 173.531 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -99.45 -12.41 20.24 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.813 0.845 . . . . 0.0 111.52 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.7 p -64.65 119.8 11.21 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.7 p -107.06 150.27 26.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.787 0.835 . . . . 0.0 111.113 -172.333 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -76.41 86.63 3.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.46 0.704 . . . . 0.0 110.194 178.017 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.408 ' HB2' HG21 ' A' ' 24' ' ' VAL . 47.2 mm-40 -98.17 110.19 55.1 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 123.607 0.763 . . . . 0.0 109.356 175.539 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.479 ' O ' HG12 ' A' ' 42' ' ' ILE . 61.7 Cg_endo -68.99 176.43 6.2 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.257 1.972 . . . . 0.0 112.114 172.646 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -60.08 -23.22 63.61 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.501 0.72 . . . . 0.0 112.354 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -58.45 -38.85 78.35 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 124.223 1.009 . . . . 0.0 110.975 172.077 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.746 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 42.6 m170 -94.18 -15.7 24.36 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.346 1.058 . . . . 0.0 112.457 -173.734 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 38' ' ' PRO . 46.6 mm -83.69 147.15 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 123.567 0.747 . . . . 0.0 112.121 -173.439 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -88.2 -70.47 0.63 Allowed 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.827 0.851 . . . . 0.0 109.896 172.96 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -77.42 115.97 53.88 Favored Pre-proline 0 CA--C 1.55 0.956 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 -176.094 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.3 -18.95 20.18 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.713 2.275 . . . . 0.0 112.955 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.455 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 75.2 mtm180 -73.99 -15.04 61.11 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.718 0.807 . . . . 0.0 111.974 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.9 mt -53.43 -52.55 59.04 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.029 0.932 . . . . 0.0 112.13 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.66 -34.97 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.238 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.455 ' SD ' ' HA ' ' A' ' 46' ' ' ARG . 57.5 mtt -59.97 -43.27 95.2 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.49 0.716 . . . . 0.0 111.017 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.62 78.48 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.389 0.676 . . . . 0.0 111.412 176.783 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -73.93 -32.94 63.75 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -75.38 -20.49 58.94 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.585 0.754 . . . . 0.0 112.118 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -68.6 -21.19 64.52 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.081 0.552 . . . . 0.0 111.267 173.216 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -123.51 -174.68 3.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.332 1.053 . . . . 0.0 109.48 175.263 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 59.84 15.17 4.67 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.978 1.311 . . . . 0.0 112.964 174.305 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 . . . . . 0 CA--C 1.558 1.256 0 C-N-CA 124.098 0.959 . . . . 0.0 110.381 -176.012 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 121.321 0.581 . . . . 0.0 109.96 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 5.3 mp -95.39 140.01 30.88 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.63 134.54 44.61 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.486 0.715 . . . . 0.0 110.37 -173.651 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 81.6 p -89.78 3.27 53.36 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.274 1.03 . . . . 0.0 110.128 171.088 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -82.05 144.24 30.97 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 125.536 1.534 . . . . 0.0 109.886 -175.58 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -96.03 137.96 34.35 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.063 0.545 . . . . 0.0 110.557 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.99 167.52 12.08 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 169.884 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.407 ' HD2' ' HB3' ' A' ' 2' ' ' GLU . 60.1 ttp180 -144.45 160.73 40.59 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.355 0.598 . . . . 0.0 109.565 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.449 ' O ' ' HA ' ' A' ' 2' ' ' GLU . . . . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 115.219 -0.9 . . . . 0.0 108.714 167.668 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.746 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 15.9 m -62.41 96.05 0.07 Allowed 'General case' 0 C--N 1.363 1.18 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.379 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.73 ' H ' ' HG2' ' A' ' 2' ' ' GLU . . . -61.57 123.79 78.29 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.483 1.113 . . . . 0.0 111.412 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 30' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' B' ' 29' ' ' ALA . 23.5 Cg_exo -65.77 166.73 19.33 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 123.152 2.568 . . . . 0.0 112.884 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.06 147.19 29.26 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 123.382 0.673 . . . . 0.0 109.414 173.246 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t -161.71 171.67 17.51 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 122.934 0.494 . . . . 0.0 110.715 -176.1 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.165 0 CA-C-O 118.826 -0.986 . . . . 0.0 110.768 175.869 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.633 0 N-CA-C 111.949 -0.461 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.487 ' HA ' ' HB1' ' B' ' 29' ' ' ALA . 8.5 pt-20 -89.17 167.89 12.74 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.346 0.658 . . . . 0.0 110.83 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -137.11 100.68 4.34 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 122.902 0.481 . . . . 0.0 109.868 177.747 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.38 134.24 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.342 1.057 . . . . 0.0 109.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.664 ' HE2' HM13 ' B' ' 27' ' ' M3L . 61.8 m-85 -132.52 159.02 40.62 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 123.227 0.611 . . . . 0.0 109.633 172.365 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.03 124.97 24.54 Favored 'General case' 0 C--O 1.249 1.064 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 170.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.468 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 6.3 p -113.59 145.86 18.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 C-N-CA 124.019 0.927 . . . . 0.0 110.349 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -78.67 -61.59 1.96 Allowed 'General case' 0 C--O 1.245 0.828 0 C-N-CA 124.042 0.937 . . . . 0.0 109.935 179.123 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.7 p -167.47 -172.09 1.85 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.041 0.936 . . . . 0.0 110.024 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.433 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.4 mm -102.2 133.6 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.14 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.476 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -85.62 -58.67 2.57 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.359 1.063 . . . . 0.0 109.19 -177.986 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.498 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 68.6 mttm -132.54 179.68 5.99 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.788 0.835 . . . . 0.0 110.264 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -156.24 154.63 31.03 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -169.977 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -164.41 170.54 15.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.421 1.088 . . . . 0.0 109.454 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.72 112.94 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 171.724 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -129.9 112.7 13.8 Favored 'General case' 0 C--O 1.24 0.585 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -174.013 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 80.6 tttt 63.77 33.92 12.45 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.021 1.328 . . . . 0.0 110.199 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.32 -14.85 43.16 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.236 -0.893 . . . . 0.0 113.744 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -84.2 112.38 20.21 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.412 0.685 . . . . 0.0 109.643 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.12 106.52 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -103.77 137.16 42.18 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.959 0.904 . . . . 0.0 110.755 -170.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.433 ' HB3' HD12 ' A' ' 10' ' ' ILE . 87.3 m-85 -119.0 126.83 52.64 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 124.326 1.05 . . . . 0.0 109.224 -171.73 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.498 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 33.4 tp -74.47 84.67 2.01 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.268 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.453 HG21 HD11 ' A' ' 42' ' ' ILE . 68.4 t -64.71 108.24 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 124.625 1.17 . . . . 0.0 111.174 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.6 tptp -94.64 102.23 14.12 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.241 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.568 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 21.1 m95 -74.72 152.58 39.09 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.663 0.785 . . . . 0.0 110.162 -178.0 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -80.7 -29.24 36.48 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 122.218 0.207 . . . . 0.0 111.262 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.36 -3.87 62.89 Favored Glycine 0 C--N 1.346 1.115 0 O-C-N 123.479 0.487 . . . . 0.0 113.023 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.568 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 62.0 m95 -124.23 127.86 25.2 Favored Pre-proline 0 CA--C 1.553 1.072 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -60.44 163.78 14.42 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 123.066 2.511 . . . . 0.0 112.234 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -61.93 -10.15 16.61 Favored 'Trans proline' 0 C--N 1.386 2.545 0 C-N-CA 123.007 2.471 . . . . 0.0 114.843 -174.419 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.84 -31.29 71.81 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.815 0.279 . . . . 0.0 110.902 172.159 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 60.6 m-85 -98.51 10.82 40.06 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 112.122 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.2 p -68.69 125.06 25.38 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.525 HG21 HM32 ' B' ' 27' ' ' M3L . 22.5 p -112.95 129.97 56.29 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.631 0.772 . . . . 0.0 111.588 -169.313 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -68.94 82.26 0.31 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.651 0.78 . . . . 0.0 110.708 175.845 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.414 ' HB2' HD11 ' A' ' 42' ' ' ILE . 21.5 mm-40 -107.9 115.68 58.39 Favored Pre-proline 0 C--O 1.243 0.749 0 C-N-CA 123.774 0.829 . . . . 0.0 109.149 177.583 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.461 ' O ' HG12 ' A' ' 42' ' ' ILE . 41.9 Cg_endo -63.68 168.91 10.84 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.481 2.121 . . . . 0.0 112.048 170.346 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.5 -19.34 63.49 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.17 -37.79 78.2 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.864 0.865 . . . . 0.0 111.129 169.122 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 36.2 m170 -87.37 -18.18 30.65 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 112.342 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.528 HD12 ' HB1' ' B' ' 25' ' ' ALA . 42.0 mm -93.74 146.15 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 124.277 0.986 . . . . 0.0 111.657 -172.019 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.499 HD11 ' HE ' ' B' ' 26' ' ' ARG . 95.6 mt -87.91 -65.51 1.01 Allowed 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.577 0.751 . . . . 0.0 110.87 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -72.12 124.27 90.62 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 122.921 0.489 . . . . 0.0 110.143 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.57 -17.88 20.36 Favored 'Trans proline' 0 C--N 1.374 1.879 0 C-N-CA 122.734 2.289 . . . . 0.0 112.995 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.543 ' HA ' ' HB3' ' A' ' 49' ' ' MET . 54.4 mtm180 -73.66 -11.44 60.41 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.784 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.77 -53.7 48.62 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.217 0.917 . . . . 0.0 110.925 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.7 p -69.3 -44.0 80.78 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.156 176.726 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.543 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 23.2 ttt -57.05 -41.95 79.63 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.395 0.678 . . . . 0.0 111.92 -177.213 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.14 73.86 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.936 0.894 . . . . 0.0 110.436 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.531 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 67.7 t80 -75.17 -28.14 59.96 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.67 176.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 23.8 mm-40 -81.82 -6.86 59.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.773 0.429 . . . . 0.0 111.822 177.118 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -68.48 -18.49 64.41 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.898 0.479 . . . . 0.0 111.513 175.861 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 20.9 ptmt -91.94 -1.47 57.26 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.838 0.455 . . . . 0.0 111.859 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -71.41 150.81 44.63 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.162 0.585 . . . . 0.0 111.478 -178.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 . . . . . 0 CA--C 1.55 0.98 0 C-N-CA 123.749 0.819 . . . . 0.0 109.494 -179.669 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 . . . . . 0 N--CA 1.483 1.208 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 53.8 tp 67.57 98.16 0.05 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.032 1.333 . . . . 0.0 111.146 176.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -155.49 120.24 4.75 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 175.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 6.2 t -73.76 120.53 19.48 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 121.37 0.605 . . . . 0.0 109.641 176.989 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -117.13 175.43 5.6 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.28 1.032 . . . . 0.0 110.079 -172.75 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -138.75 111.26 7.55 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.378 0.671 . . . . 0.0 109.502 176.097 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.528 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -99.37 167.53 10.58 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.868 174.515 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.503 ' HD3' ' HB3' ' B' ' 29' ' ' ALA . 15.2 ttm180 -134.7 152.21 51.59 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 123.255 0.622 . . . . 0.0 109.531 -176.704 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.664 HM13 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.239 0.544 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 172.835 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 32.4 t 72.59 -89.24 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.023 0.929 . . . . 0.0 110.42 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 29' ' ' ALA . . . . . 0.503 ' HB3' ' HD3' ' B' ' 26' ' ' ARG . . . 38.11 104.09 0.01 OUTLIER Pre-proline 0 C--N 1.373 1.614 0 C-N-CA 126.542 1.937 . . . . 0.0 115.373 170.376 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 30' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' B' ' 29' ' ' ALA . 14.9 Cg_endo -53.15 102.68 0.08 OUTLIER 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 123.013 2.475 . . . . 0.0 111.938 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.57 163.01 28.59 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.772 0.829 . . . . 0.0 111.612 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 33.1 p -64.32 93.9 0.1 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.168 0.987 . . . . 0.0 111.692 -174.346 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.263 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.936 176.179 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 111.222 -0.751 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.24 108.92 2.05 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.544 0.738 . . . . 0.0 110.157 176.416 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -133.07 152.04 51.99 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.471 0.653 . . . . 0.0 111.27 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.7 t -117.42 131.99 68.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.797 1.639 . . . . 0.0 107.871 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.421 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 69.1 m-85 -132.66 164.45 26.69 Favored 'General case' 0 C--O 1.248 0.98 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 173.413 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 104.93 1.54 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 168.184 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.519 HG13 HD11 ' A' ' 47' ' ' LEU . 2.9 p -89.57 138.57 19.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.711 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.08 -178.302 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.598 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 38.2 tt0 -71.81 -62.56 1.37 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.231 1.012 . . . . 0.0 109.561 176.52 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.404 ' HA ' HD12 ' A' ' 47' ' ' LEU . 27.7 p -173.6 -172.57 0.78 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.512 1.125 . . . . 0.0 109.216 -177.219 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.447 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.4 mm -94.78 133.16 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 169.241 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -99.2 -37.06 9.45 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.186 0.594 . . . . 0.0 110.558 -174.489 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.441 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 65.9 mttm -143.69 169.96 16.76 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.992 0.917 . . . . 0.0 109.921 176.54 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -152.48 149.29 28.39 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -174.806 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -163.71 -175.47 4.15 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.414 1.085 . . . . 0.0 109.487 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -144.02 141.63 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 173.445 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -137.9 107.89 6.35 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.616 0.767 . . . . 0.0 109.045 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.4 mttt 61.75 36.5 16.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.869 0.868 . . . . 0.0 111.482 173.559 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.62 -13.82 66.46 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.57 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -88.12 107.45 18.77 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.9 t -83.53 108.49 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -96.52 138.75 33.64 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.465 0.706 . . . . 0.0 110.197 -169.928 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.447 ' HB3' HD12 ' A' ' 10' ' ' ILE . 71.1 m-85 -122.66 121.94 37.61 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.898 0.879 . . . . 0.0 108.633 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.441 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 26.1 tp -71.68 86.64 0.93 Allowed 'General case' 0 C--O 1.24 0.583 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 174.424 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 78.4 t -70.85 104.82 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.494 -176.237 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -81.37 100.24 9.13 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.421 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 21.7 m95 -76.14 124.43 27.41 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 172.497 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.598 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -72.37 113.93 9.94 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.658 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 118.07 -14.65 12.4 Favored Glycine 0 C--N 1.346 1.139 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.215 -172.494 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -110.07 135.19 20.54 Favored Pre-proline 0 N--CA 1.475 0.799 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.29 155.24 30.68 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.746 2.297 . . . . 0.0 112.869 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.43 -13.44 10.29 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 123.52 2.813 . . . . 0.0 114.298 176.531 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -82.75 -46.47 13.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.693 0.397 . . . . 0.0 110.196 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -79.68 -1.36 37.99 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.252 0.621 . . . . 0.0 112.206 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.6 p -64.68 132.14 48.87 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 165.951 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' THR . . . . . 0.687 HG21 HM32 ' B' ' 27' ' ' M3L . 38.1 p -109.75 138.21 46.44 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.039 0.536 . . . . 0.0 111.98 -166.428 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -74.29 87.31 1.98 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.41 0.684 . . . . 0.0 110.107 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -103.74 125.1 35.63 Favored Pre-proline 0 N--CA 1.468 0.473 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.43 ' O ' HG12 ' A' ' 42' ' ' ILE . 56.3 Cg_endo -67.55 166.37 24.14 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 121.845 1.697 . . . . 0.0 112.447 172.451 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -52.24 -31.08 30.64 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 125.457 1.503 . . . . 0.0 112.337 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -60.45 -35.75 76.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.518 1.527 . . . . 0.0 110.99 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -91.65 -14.34 30.29 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.2 1.0 . . . . 0.0 112.989 -175.073 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 38' ' ' PRO . 41.2 mm -88.41 153.07 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.076 0.55 . . . . 0.0 110.914 -175.45 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' B' ' 24' ' ' ALA . 89.1 mt -90.85 -67.22 0.86 Allowed 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 171.842 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -82.97 134.61 46.27 Favored Pre-proline 0 CA--C 1.565 1.555 0 C-N-CA 123.001 0.521 . . . . 0.0 110.588 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' PRO . . . . . 0.43 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 88.9 Cg_endo -79.83 -32.04 1.66 Allowed 'Trans proline' 0 CA--C 1.571 2.342 0 C-N-CA 122.72 2.28 . . . . 0.0 116.072 -177.549 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.43 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.26 0.0 OUTLIER -71.42 -11.38 60.85 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -166.739 . . . . . . . . 4 4 . 1 . 014 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.519 HD11 HG13 ' A' ' 7' ' ' VAL . 2.9 mm? -53.54 -46.63 70.25 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.807 0.731 . . . . 0.0 110.203 171.278 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 98.1 t -70.26 -42.38 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.758 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -68.98 -42.43 76.55 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.406 -175.095 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.21 -30.91 71.85 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.951 0.9 . . . . 0.0 111.868 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.02 -52.27 25.49 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.015 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -81.76 -17.7 46.78 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -172.032 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -69.38 -32.38 71.37 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 117.992 0.36 . . . . 0.0 111.742 -176.268 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -91.15 147.4 23.09 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.544 0.737 . . . . 0.0 109.473 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 60.46 96.06 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.143 1.377 . . . . 0.0 111.152 -171.613 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.56 1.345 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.525 -176.549 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -107.89 62.35 0.61 Allowed 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 169.086 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.52 -174.32 4.9 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 114.326 -1.306 . . . . 0.0 109.086 -177.394 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 74.4 p 54.06 29.83 10.91 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 124.713 1.205 . . . . 0.0 111.632 -175.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 23' ' ' LYS . . . . . 0.483 ' HE3' ' HA ' ' B' ' 23' ' ' LYS . 0.0 OUTLIER -87.22 176.4 7.58 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.747 176.213 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' B' B ' 24' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' A' ' 43' ' ' LEU . . . -117.79 112.34 20.27 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.874 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -103.08 168.61 9.07 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 166.947 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.451 ' NH1' ' HA ' ' B' ' 30' ' ' PRO . 75.3 ttt180 -145.56 163.1 35.81 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.789 0.328 . . . . 0.0 110.139 -172.488 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.687 HM32 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.544 0.712 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 56.4 m -165.8 173.31 10.77 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 122.819 0.448 . . . . 0.0 111.435 -172.926 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.77 139.59 86.31 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.054 0.941 . . . . 0.0 111.886 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 30' ' ' PRO . . . . . 0.451 ' HA ' ' NH1' ' B' ' 26' ' ' ARG . 47.3 Cg_exo -59.79 -17.17 41.74 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 123.191 2.594 . . . . 0.0 113.579 174.972 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . 65.75 19.19 11.35 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.711 1.204 . . . . 0.0 111.654 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 43.5 p -113.64 150.34 33.31 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 124.533 1.133 . . . . 0.0 109.724 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.418 0 CA-C-O 118.73 -1.039 . . . . 0.0 111.882 177.425 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.125 0 N-CA-C 112.012 -0.435 . . . . 0.0 112.012 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.414 ' HA ' ' HB3' ' B' ' 28' ' ' SER . 4.2 mp0 62.12 9.76 3.33 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.769 1.228 . . . . 0.0 113.754 171.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -93.99 142.82 26.95 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 121.338 0.59 . . . . 0.0 110.887 -169.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 39.1 t -105.33 140.31 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 114.255 -1.339 . . . . 0.0 109.371 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -132.1 152.27 51.31 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.776 0.83 . . . . 0.0 109.166 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.03 128.27 35.09 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.46 132.47 70.62 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.439 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -69.29 -61.7 1.68 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.996 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.8 p -167.59 -169.34 1.18 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.758 -172.454 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.527 HD12 ' HB3' ' A' ' 22' ' ' TYR . 51.2 mm -105.5 139.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.418 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' HB3' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -92.64 -48.5 6.56 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.676 0.791 . . . . 0.0 109.97 -179.875 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -137.53 161.47 36.31 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.395 0.678 . . . . 0.0 111.156 -176.87 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -146.22 142.91 28.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.819 0.848 . . . . 0.0 109.179 -177.4 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -165.13 143.99 6.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.788 0.835 . . . . 0.0 109.137 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 7.2 p -92.09 125.29 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.943 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -133.15 104.52 6.54 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.992 0.517 . . . . 0.0 109.611 -169.415 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 62.52 30.64 17.16 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.008 0.923 . . . . 0.0 110.656 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 -17.46 51.07 Favored Glycine 0 C--N 1.348 1.237 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.569 -174.045 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -94.87 109.99 21.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.632 0.773 . . . . 0.0 109.272 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.7 t -79.24 111.44 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.024 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -90.53 143.75 26.45 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 123.696 0.798 . . . . 0.0 109.786 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.527 ' HB3' HD12 ' A' ' 10' ' ' ILE . 98.6 m-85 -125.94 123.51 38.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.315 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.432 HD23 ' HB3' ' A' ' 11' ' ' ARG . 43.1 tp -71.47 84.23 0.82 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 169.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.662 HG21 HD11 ' A' ' 42' ' ' ILE . 99.8 t -69.09 104.37 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.086 -172.395 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -78.06 99.76 6.24 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.899 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.535 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.8 m95 -69.07 139.54 54.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.958 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.18 -31.63 70.37 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 120.718 0.294 . . . . 0.0 110.559 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.74 -26.16 47.07 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.929 -0.578 . . . . 0.0 113.616 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 94.4 m95 -110.87 138.48 21.13 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 122.968 0.507 . . . . 0.0 111.363 -172.3 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -52.95 157.65 7.72 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.526 2.817 . . . . 0.0 113.248 173.359 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -57.82 -20.24 42.77 Favored 'Trans proline' 0 C--N 1.383 2.362 0 C-N-CA 123.327 2.685 . . . . 0.0 113.925 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -80.77 -31.39 35.87 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.377 0.671 . . . . 0.0 111.434 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -88.9 -4.37 58.48 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.383 0.673 . . . . 0.0 111.174 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.8 m -68.19 137.45 54.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.216 0.607 . . . . 0.0 109.606 172.071 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.9 p -111.88 143.2 43.23 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.051 0.541 . . . . 0.0 111.826 -170.079 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -75.57 85.66 2.64 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.669 0.788 . . . . 0.0 110.145 177.633 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.507 ' HB2' HD11 ' A' ' 42' ' ' ILE . 28.1 mm-40 -102.98 128.06 28.53 Favored Pre-proline 0 C--O 1.238 0.465 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.265 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.15 162.28 40.85 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.753 1.636 . . . . 0.0 110.9 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.98 -16.48 43.45 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.984 0.514 . . . . 0.0 112.01 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -55.67 -50.84 69.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.803 1.241 . . . . 0.0 109.996 170.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -76.96 -16.67 59.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.732 -174.515 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.662 HD11 HG21 ' A' ' 24' ' ' VAL . 46.0 mm -91.43 147.03 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.207 1.003 . . . . 0.0 111.161 -172.624 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 62.6 mt -87.34 -71.12 0.58 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 122.966 0.506 . . . . 0.0 109.641 172.511 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' ASP . . . . . 0.432 ' O ' HD23 ' A' ' 47' ' ' LEU . 14.3 t70 -68.92 112.58 11.94 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 122.919 0.488 . . . . 0.0 110.024 -176.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -81.65 -9.15 12.32 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.479 2.12 . . . . 0.0 113.187 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ttp180 -70.98 -16.54 62.64 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.787 0.835 . . . . 0.0 110.081 -178.197 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 44' ' ' ASP . 4.5 mm? -49.88 -47.39 52.01 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.759 0.824 . . . . 0.0 111.513 169.28 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.9 t -67.97 -50.43 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.823 0.849 . . . . 0.0 110.615 -178.089 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.411 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 25.8 mmt -58.5 -53.27 60.19 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.072 -177.04 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.89 78.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.574 1.15 . . . . 0.0 112.164 -177.09 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -62.63 -55.11 30.1 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.548 177.341 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -74.82 -6.18 47.62 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -170.467 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' MET . 60.7 mt-10 -60.81 -31.2 70.6 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.02 0.438 . . . . 0.0 110.687 171.708 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 137.71 41.39 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.897 0.879 . . . . 0.0 108.817 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 65.12 98.7 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 124.122 0.969 . . . . 0.0 111.855 -175.984 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.086 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 176.303 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 . . . . . 0 N--CA 1.479 1.004 0 CA-C-O 120.989 0.423 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -112.32 135.72 52.66 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 172.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.43 -174.1 1.85 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.577 0.751 . . . . 0.0 110.253 -177.144 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.2 t -67.62 84.19 0.18 Allowed 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 122.45 1.119 . . . . 0.0 109.91 172.416 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 23' ' ' LYS . . . . . 0.419 ' HE2' HD22 ' A' ' 47' ' ' LEU . 7.3 mtpm? -135.03 123.0 22.59 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-N 114.204 -1.362 . . . . 0.0 107.928 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -136.77 130.09 31.43 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.557 0.694 . . . . 0.0 110.28 -178.602 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.63 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -109.73 166.34 10.99 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.729 178.284 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -131.48 157.29 43.92 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 123.343 0.657 . . . . 0.0 109.326 -172.106 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.797 0 C-N-CA 122.95 0.5 . . . . 0.0 111.524 -179.523 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.414 ' HB3' ' HA ' ' A' ' 2' ' ' GLU . 33.3 t -159.27 138.4 11.21 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.476 0.179 . . . . 0.0 111.019 -172.878 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.6 118.81 74.15 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 123.581 0.752 . . . . 0.0 110.468 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.31 -9.28 24.67 Favored 'Trans proline' 0 C--N 1.381 2.248 0 C-N-CA 122.651 2.234 . . . . 0.0 112.602 174.84 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.89 3.55 50.97 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.937 0.895 . . . . 0.0 112.504 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 11.0 t -78.61 -28.76 45.71 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.558 0.343 . . . . 0.0 111.448 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.811 -0.994 . . . . 0.0 111.292 -176.085 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.9 0 N-CA-C 111.703 -0.559 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -158.83 93.44 1.17 Allowed 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.457 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.434 ' HB2' ' HB3' ' B' ' 27' ' ' M3L . 26.9 mp0 -112.06 90.61 3.39 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.591 0.756 . . . . 0.0 109.609 -178.293 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.556 HG22 ' HB3' ' B' ' 26' ' ' ARG . 48.4 t -85.74 103.94 13.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 123.721 0.808 . . . . 0.0 109.092 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -129.38 174.13 9.9 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.458 0.703 . . . . 0.0 110.703 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.76 114.26 20.28 Favored 'General case' 0 C--O 1.245 0.864 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.013 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.613 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.7 p -107.72 149.49 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.658 1.183 . . . . 0.0 109.93 -178.831 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 8.1 tp10 -86.02 -59.0 2.42 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.925 0.393 . . . . 0.0 109.992 174.834 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.487 ' HA ' HD12 ' A' ' 47' ' ' LEU . 15.9 p -169.6 179.89 3.61 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.77 -171.289 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.592 HD12 ' HB3' ' A' ' 22' ' ' TYR . 40.9 mm -86.64 128.61 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 172.056 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.503 ' HD2' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -76.28 -49.3 17.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.887 0.875 . . . . 0.0 109.472 176.518 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.8 tttp -148.72 164.71 33.56 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.61 0.364 . . . . 0.0 110.054 -172.483 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -142.24 154.01 44.42 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.151 0.58 . . . . 0.0 109.462 -171.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' ARG . . . . . 0.568 ' HG3' ' HB2' ' A' ' 21' ' ' GLU . 10.0 ptm180 -171.45 -174.24 1.38 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.247 1.419 . . . . 0.0 108.831 179.394 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -143.71 142.51 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.496 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -137.33 104.65 5.44 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.584 0.754 . . . . 0.0 109.069 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm 59.72 34.35 22.03 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.786 1.234 . . . . 0.0 111.302 177.869 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.79 -14.57 65.01 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 115.241 -0.89 . . . . 0.0 114.292 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -85.2 109.87 18.62 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.6 t -78.22 111.05 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -175.488 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.568 ' HB2' ' HG3' ' A' ' 14' ' ' ARG . 5.3 mm-40 -95.86 140.27 30.87 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.865 0.866 . . . . 0.0 110.575 -168.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.592 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.6 m-85 -129.99 121.52 26.69 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.871 0.868 . . . . 0.0 109.146 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.503 HD23 ' HD2' ' A' ' 11' ' ' ARG . 24.0 tp -73.68 80.06 1.53 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.3 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.568 HG21 HD11 ' A' ' 42' ' ' ILE . 40.8 t -65.17 106.18 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.525 1.13 . . . . 0.0 109.708 -175.881 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.447 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 13.7 tptm -90.3 104.61 17.17 Favored 'General case' 0 C--O 1.243 0.749 0 C-N-CA 123.239 0.615 . . . . 0.0 110.019 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.613 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 36.9 m95 -77.56 127.07 31.89 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.238 1.015 . . . . 0.0 108.937 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.562 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -64.5 -28.8 69.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -166.466 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.17 -2.81 54.46 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 116.749 -0.205 . . . . 0.0 113.209 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.595 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 76.9 m95 -111.44 150.09 41.6 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 123.642 0.777 . . . . 0.0 110.727 -173.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -64.73 158.54 50.02 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.861 2.374 . . . . 0.0 111.836 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -62.81 -18.53 64.98 Favored 'Trans proline' 0 C--N 1.378 2.103 0 C-N-CA 123.067 2.511 . . . . 0.0 113.686 -179.094 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -71.55 -30.01 65.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.573 0.349 . . . . 0.0 110.511 173.993 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.506 ' HD2' HM11 ' B' ' 27' ' ' M3L . 12.6 m-85 -86.36 -5.03 59.26 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.712 0.805 . . . . 0.0 111.862 176.982 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 t -68.92 123.88 22.19 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 170.783 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.7 p -115.87 136.74 52.75 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.119 0.967 . . . . 0.0 112.12 -165.298 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -76.5 84.92 3.21 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 172.945 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.517 ' HB2' HD11 ' A' ' 42' ' ' ILE . 49.1 mm-40 -101.05 140.4 21.27 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 123.358 0.663 . . . . 0.0 109.222 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -78.48 158.97 29.07 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 121.794 1.663 . . . . 0.0 111.602 174.304 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -54.9 -25.01 26.27 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 123.907 0.883 . . . . 0.0 112.083 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -59.3 -31.46 69.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.685 1.194 . . . . 0.0 112.077 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.506 ' HB3' ' HB2' ' B' ' 28' ' ' SER . 14.8 m-70 -127.83 25.0 6.02 Favored 'General case' 0 C--O 1.25 1.083 0 C-N-CA 123.753 0.821 . . . . 0.0 112.538 -170.198 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.568 HD11 HG21 ' A' ' 24' ' ' VAL . 37.5 mm -103.9 150.8 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 125.041 1.336 . . . . 0.0 110.293 168.934 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.492 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 4.9 tt -81.23 -82.57 0.12 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.225 1.01 . . . . 0.0 108.826 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -78.5 132.51 65.35 Favored Pre-proline 0 CA--C 1.559 1.31 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -80.45 -16.82 10.46 Favored 'Trans proline' 0 C--N 1.377 2.028 0 C-N-CA 122.57 2.18 . . . . 0.0 113.711 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ARG . . . . . 0.438 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 65.1 mtm180 -71.98 -11.12 60.62 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.866 0.866 . . . . 0.0 113.203 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.497 HD11 HG13 ' A' ' 7' ' ' VAL . 3.1 mm? -58.7 -44.49 90.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 118.774 0.715 . . . . 0.0 109.812 167.657 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.37 -44.21 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.386 1.074 . . . . 0.0 110.52 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.438 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 96.0 mmm -65.25 -51.64 59.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.196 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.68 70.49 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.955 0.902 . . . . 0.0 111.547 179.029 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -65.92 -49.17 68.91 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.001 0.521 . . . . 0.0 110.304 175.572 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.17 -5.71 59.29 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.679 0.792 . . . . 0.0 112.28 -177.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -66.63 -29.12 69.08 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.592 0.757 . . . . 0.0 110.191 168.434 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 3.0 mptp? -101.57 150.85 22.65 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.85 0.86 . . . . 0.0 109.87 178.672 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 57.16 77.88 0.25 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.057 1.343 . . . . 0.0 111.879 178.194 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 . . . . . 0 C--O 1.253 1.271 0 CA-C-O 119.043 -0.503 . . . . 0.0 109.98 178.029 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.81 0.338 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 48.3 mt -87.81 136.17 33.07 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.708 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 8' ' ' GLU . . . -77.95 -27.48 49.28 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.217 0.607 . . . . 0.0 110.985 -177.625 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 10.2 t 42.06 67.24 0.6 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 125.665 1.586 . . . . 0.0 114.095 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -128.29 159.12 36.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.182 0.993 . . . . 0.0 110.427 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.2 134.31 47.65 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 171.657 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.54 -175.6 2.98 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 171.533 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.556 ' HB3' HG22 ' A' ' 4' ' ' VAL . 4.5 ptp180 -143.58 141.53 30.69 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.4 0.68 . . . . 0.0 109.591 -178.248 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.506 HM11 ' HD2' ' A' ' 33' ' ' TYR . . . . . . . . 0 C--O 1.237 0.42 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 168.153 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.506 ' HB2' ' HB3' ' A' ' 41' ' ' HIS . 69.5 m -85.55 128.51 34.77 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 175.133 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.04 128.66 92.64 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 123.481 0.712 . . . . 0.0 111.478 -171.316 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.1 97.42 0.66 Allowed 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 122.168 1.912 . . . . 0.0 110.189 168.231 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -57.55 -32.42 67.09 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.712 0.805 . . . . 0.0 110.641 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 24.5 m -101.79 103.04 13.74 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 166.516 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.67 -1.072 . . . . 0.0 110.706 174.527 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.462 0 N-CA-C 112.251 -0.34 . . . . 0.0 112.251 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.447 ' HG3' ' NH2' ' B' ' 26' ' ' ARG . 1.2 pm0 -109.68 138.87 45.42 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.419 1.088 . . . . 0.0 109.277 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -159.29 150.65 20.15 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.95 0.5 . . . . 0.0 111.538 -170.828 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.9 t -100.66 140.12 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 124.189 0.995 . . . . 0.0 110.549 -177.337 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -142.28 163.28 33.29 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.062 0.945 . . . . 0.0 110.195 171.854 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.84 153.55 36.75 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.013 174.475 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.462 HG11 ' HB2' ' B' ' 25' ' ' ALA . 7.3 p -155.31 153.56 7.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.645 0 C-N-CA 124.311 1.045 . . . . 0.0 108.415 -176.457 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -121.9 -36.77 2.95 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.722 175.179 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -133.75 138.86 46.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.561 -166.06 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.8 mm -91.08 111.82 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 161.864 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.98 -54.19 14.38 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.708 0.63 . . . . 0.0 109.997 -173.943 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.421 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 99.2 mttt -139.2 176.84 8.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.823 0.849 . . . . 0.0 110.568 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -157.91 143.16 16.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.215 1.006 . . . . 0.0 108.933 -173.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -155.51 166.02 34.8 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.085 0.954 . . . . 0.0 108.582 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.4 t -127.86 114.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.422 ' HD3' ' OE1' ' A' ' 21' ' ' GLU . 74.5 mtp180 -125.34 115.95 21.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 123.983 0.913 . . . . 0.0 108.92 -178.566 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt 64.21 24.76 13.47 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 125.458 1.503 . . . . 0.0 111.55 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.04 -16.04 60.5 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.755 -177.491 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.831 -0.804 . . . . 0.0 108.831 178.254 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 t -82.65 109.09 16.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.379 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.422 ' OE1' ' HD3' ' A' ' 16' ' ' ARG . 50.9 mt-10 -94.81 141.47 28.59 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.801 0.84 . . . . 0.0 110.279 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -120.18 120.49 36.31 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.784 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.421 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 33.9 tp -71.58 86.97 0.9 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.799 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.6 t -73.17 107.98 4.19 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.976 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.452 ' O ' HG23 ' A' ' 7' ' ' VAL . 20.5 tptm -78.69 99.89 6.81 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 175.945 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 68.0 m95 -69.94 129.67 40.12 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 175.202 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -20.59 62.2 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.006 0.366 . . . . 0.0 111.329 -176.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -99.05 7.46 60.47 Favored Glycine 0 C--N 1.354 1.57 0 C-N-CA 123.338 0.494 . . . . 0.0 113.626 178.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -133.7 141.1 38.78 Favored Pre-proline 0 N--CA 1.486 1.374 0 C-N-CA 123.639 0.776 . . . . 0.0 109.529 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -62.84 159.32 38.28 Favored 'Trans proline' 0 CA--C 1.565 2.031 0 C-N-CA 122.214 1.943 . . . . 0.0 110.717 168.287 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.22 0.56 4.41 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.083 2.522 . . . . 0.0 114.221 -174.018 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.09 -14.56 59.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.237 0.615 . . . . 0.0 111.562 170.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -119.27 7.25 11.24 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.663 0.785 . . . . 0.0 111.052 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.4 p -69.27 122.58 19.16 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 28.9 p -101.44 143.71 31.13 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.329 0.652 . . . . 0.0 111.314 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -76.82 86.35 3.41 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -94.5 113.08 60.1 Favored Pre-proline 0 N--CA 1.472 0.632 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 174.874 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 36.7 Cg_endo -64.71 172.48 6.86 Favored 'Trans proline' 0 C--N 1.371 1.728 0 C-N-CA 121.787 1.658 . . . . 0.0 113.616 175.703 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLU . . . . . 0.517 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 11.4 pt-20 -43.75 -41.86 5.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 126.696 1.998 . . . . 0.0 114.156 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLU . . . . . 0.517 ' HG3' ' HG3' ' A' ' 39' ' ' GLU . 24.2 mt-10 -75.09 -29.57 60.68 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.694 1.198 . . . . 0.0 111.015 -176.588 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.472 ' CD2' ' HA ' ' B' ' 28' ' ' SER . 2.2 m80 -86.46 -2.96 58.9 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.405 1.082 . . . . 0.0 112.858 -172.171 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.87 149.73 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 124.889 1.276 . . . . 0.0 110.471 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.555 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 30.5 mt -81.98 -77.62 0.22 Allowed 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 167.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -68.31 110.53 5.89 Favored Pre-proline 0 C--N 1.362 1.12 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -170.357 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.68 -22.7 23.75 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.425 2.083 . . . . 0.0 112.076 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -70.81 -14.83 62.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.597 0.759 . . . . 0.0 111.443 -177.814 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.6 mt -57.29 -46.51 83.08 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.713 0.805 . . . . 0.0 111.227 170.846 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -63.05 -53.18 49.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.754 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.463 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 1.3 mpt? -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.23 0.956 . . . . 0.0 111.141 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.4 99.43 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.956 0.902 . . . . 0.0 110.74 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -63.84 -42.24 97.64 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.175 0.99 . . . . 0.0 110.391 174.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.641 ' HA ' ' HB2' ' A' ' 55' ' ' GLU . 59.0 mt-10 -76.12 -10.44 59.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.758 0.823 . . . . 0.0 112.953 -174.487 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 49' ' ' MET . 52.0 mt-10 -65.1 -29.94 70.84 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.473 0.309 . . . . 0.0 110.967 172.904 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.64 30.94 3.73 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.671 0.788 . . . . 0.0 110.24 -177.234 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.641 ' HB2' ' HA ' ' A' ' 52' ' ' GLU . 39.2 tt0 -74.25 88.28 2.0 Allowed 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 176.624 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 . . . . . 0 CA--C 1.558 1.256 0 C-N-CA 124.443 1.097 . . . . 0.0 108.84 -178.137 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 120.973 0.416 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 62.1 mt -72.19 -34.66 68.57 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.804 0.842 . . . . 0.0 110.72 179.354 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.04 130.52 37.76 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.299 0.639 . . . . 0.0 109.689 176.977 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 11.9 t -94.84 5.19 52.61 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.888 0.875 . . . . 0.0 111.833 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -50.92 142.69 11.35 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 124.969 1.308 . . . . 0.0 111.905 -175.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -109.63 116.23 31.35 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.925 0.49 . . . . 0.0 110.42 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.462 ' HB2' HG11 ' A' ' 7' ' ' VAL . . . -94.54 -173.33 3.0 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 167.246 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.555 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 15.3 ttt180 -153.06 146.1 24.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.26 -176.127 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.553 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 166.918 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.472 ' HA ' ' CD2' ' A' ' 41' ' ' HIS . 51.1 m 94.4 158.17 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.512 1.525 . . . . 0.0 111.679 170.323 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.42 153.31 95.08 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 123.959 0.904 . . . . 0.0 112.391 -172.455 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -52.04 117.11 3.26 Favored 'Trans proline' 0 C--N 1.379 2.143 0 C-N-CA 123.353 2.702 . . . . 0.0 112.853 173.662 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.64 89.45 7.73 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.636 0.774 . . . . 0.0 109.964 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 23.8 m -73.19 130.31 39.97 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.54 0.736 . . . . 0.0 111.256 -176.645 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.317 0 CA-C-O 119.343 -0.698 . . . . 0.0 113.816 -177.842 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.445 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.42 164.06 18.12 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.319 0.648 . . . . 0.0 109.683 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -89.47 104.14 16.72 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.513 0.725 . . . . 0.0 111.603 -166.749 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.79 139.73 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.504 1.122 . . . . 0.0 108.611 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -137.79 167.61 21.37 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.777 . . . . 0.0 109.989 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.06 124.5 25.09 Favored 'General case' 0 C--O 1.248 0.974 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.519 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.445 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -110.25 145.29 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.655 0.782 . . . . 0.0 110.534 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -90.0 -46.12 8.72 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.27 1.028 . . . . 0.0 110.763 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.4 p -175.46 -170.12 0.4 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.487 0.715 . . . . 0.0 110.663 -172.254 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.452 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.3 mm -111.79 120.98 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 168.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.423 ' HB3' HD23 ' A' ' 23' ' ' LEU . 0.4 OUTLIER -74.31 -56.25 5.09 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.077 0.951 . . . . 0.0 109.677 -179.313 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.468 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 33.6 mtmm -137.61 176.52 8.63 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.962 0.905 . . . . 0.0 111.066 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -156.99 152.53 26.73 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.756 1.222 . . . . 0.0 108.448 -173.157 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -165.7 164.15 19.0 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.452 0.701 . . . . 0.0 109.723 177.216 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.481 HG22 HG22 ' A' ' 20' ' ' VAL . 38.6 t -108.87 126.92 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 166.2 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -139.0 105.77 5.38 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.413 1.085 . . . . 0.0 108.94 -170.334 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 62.26 26.86 16.11 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.375 1.07 . . . . 0.0 111.623 -176.278 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.08 -15.46 62.83 Favored Glycine 0 C--N 1.348 1.205 0 CA-C-N 115.733 -0.667 . . . . 0.0 113.175 -176.215 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.257 0.623 . . . . 0.0 110.009 178.631 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.481 HG22 HG22 ' A' ' 15' ' ' VAL . 43.7 t -76.21 104.47 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 175.751 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -98.62 149.29 22.93 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.527 0.731 . . . . 0.0 110.679 -176.014 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.452 ' HB3' HD12 ' A' ' 10' ' ' ILE . 92.8 m-85 -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.175 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LEU . . . . . 0.468 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 36.4 tp -70.12 86.71 0.56 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.028 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.425 HG21 HD11 ' A' ' 42' ' ' ILE . 75.7 t -70.63 107.35 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.106 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -79.79 102.07 8.85 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.544 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.0 m95 -77.28 154.27 33.1 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.648 -177.399 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -76.74 -33.25 58.13 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.419 0.687 . . . . 0.0 109.662 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.26 -25.51 28.42 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.529 -0.759 . . . . 0.0 113.414 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.544 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 97.6 m95 -106.54 135.22 19.53 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-N 117.338 0.569 . . . . 0.0 111.424 -176.564 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -53.98 158.76 8.38 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.461 2.774 . . . . 0.0 113.098 170.71 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -63.68 -16.81 56.96 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 123.225 2.617 . . . . 0.0 113.621 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -79.95 -36.72 35.77 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.884 0.474 . . . . 0.0 110.858 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -83.6 -5.76 59.26 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.322 0.649 . . . . 0.0 111.37 177.552 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.8 m -66.58 134.73 52.95 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 169.913 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.7 p -120.4 159.27 25.44 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.295 0.638 . . . . 0.0 111.824 -169.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.02 84.51 6.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.928 0.891 . . . . 0.0 110.464 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -101.34 111.79 64.16 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.44 177.121 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -61.57 165.51 13.33 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 122.135 1.89 . . . . 0.0 112.326 172.36 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -60.16 -21.45 61.67 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.216 1.007 . . . . 0.0 112.734 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.38 -33.04 71.89 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.249 1.02 . . . . 0.0 111.017 173.821 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.628 ' HA ' ' HB3' ' B' ' 28' ' ' SER . 2.0 m80 -83.26 -29.88 28.07 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.538 -175.632 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.481 HD12 ' HB1' ' B' ' 25' ' ' ALA . 40.1 mm -88.83 144.87 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.936 0.895 . . . . 0.0 111.949 -165.817 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.0 mt -85.31 -72.79 0.47 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.426 0.69 . . . . 0.0 111.061 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.09 131.99 77.66 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -78.53 -18.63 12.05 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.666 2.244 . . . . 0.0 114.027 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -71.71 -13.19 61.65 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -172.03 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' LEU . . . . . 0.434 HD11 HG13 ' A' ' 7' ' ' VAL . 2.6 mm? -61.6 -47.38 85.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 168.223 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 48' ' ' VAL . . . . . 0.482 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 91.5 t -64.21 -46.54 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.649 176.895 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.2 mmt -57.82 -39.71 78.25 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.674 0.789 . . . . 0.0 111.566 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.25 85.24 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.201 1.0 . . . . 0.0 110.885 177.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.416 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 68.1 t80 -73.14 -35.98 66.6 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.716 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 35.9 mm-40 -69.86 -13.1 62.1 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.193 0.597 . . . . 0.0 112.271 -175.527 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -71.84 -9.05 57.76 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.583 0.753 . . . . 0.0 112.784 179.085 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.67 174.95 9.22 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.539 1.136 . . . . 0.0 109.733 173.94 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 54.0 22.72 3.57 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 126.451 1.9 . . . . 0.0 111.832 -166.061 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 CA--C 1.562 1.425 0 C-N-CA 125.064 1.346 . . . . 0.0 111.845 -171.526 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 92.5 mt -122.43 97.94 5.7 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 173.73 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.77 154.09 30.25 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.146 0.578 . . . . 0.0 110.046 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 14.3 t -130.61 25.34 5.08 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.785 0.834 . . . . 0.0 109.444 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -78.07 -174.76 3.76 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.598 -173.286 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.82 108.02 18.67 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.804 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.481 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.06 155.42 16.81 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 163.027 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.647 ' HE ' ' HB2' ' B' ' 28' ' ' SER . 7.5 ttt180 -141.45 154.24 45.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -169.6 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.405 ' HE2' ' CZ2' ' A' ' 26' ' ' TRP . . . . . . . . 0 C--O 1.238 0.471 0 C-N-CA 124.635 1.174 . . . . 0.0 108.451 176.617 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 28' ' ' SER . . . . . 0.647 ' HB2' ' HE ' ' B' ' 26' ' ' ARG . 8.6 t -72.25 83.02 1.03 Allowed 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.011 175.833 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.04 140.95 86.86 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 124.274 1.029 . . . . 0.0 111.381 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -74.04 -7.57 20.05 Favored 'Trans proline' 0 C--N 1.375 1.937 0 C-N-CA 122.348 2.032 . . . . 0.0 112.967 -174.862 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . 65.88 -72.06 0.08 Allowed 'General case' 0 C--N 1.36 1.042 0 C-N-CA 125.442 1.497 . . . . 0.0 111.354 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 15.4 t -72.9 141.15 47.88 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.335 0.654 . . . . 0.0 110.125 173.344 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.241 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -176.335 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.937 0 N-CA-C 112.102 -0.399 . . . . 0.0 112.102 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.494 ' HG3' ' HD2' ' B' ' 26' ' ' ARG . 0.0 OUTLIER -153.65 -171.68 3.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.505 0.722 . . . . 0.0 109.6 177.752 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 3' ' ' GLN . . . . . 0.433 ' HB2' ' HB3' ' B' ' 27' ' ' M3L . 1.7 mp0 -81.39 82.19 7.29 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 123.679 0.792 . . . . 0.0 111.084 -172.652 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.5 t -112.47 124.84 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.389 1.076 . . . . 0.0 108.345 172.927 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' PHE . . . . . 0.484 ' HE2' HM23 ' B' ' 27' ' ' M3L . 94.4 m-85 -135.23 162.29 32.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.7 0.8 . . . . 0.0 109.623 178.078 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.91 107.06 5.09 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.448 0.699 . . . . 0.0 109.197 175.381 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' VAL . . . . . 0.523 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.1 p -85.43 135.0 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.09 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' GLU . . . . . 0.512 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.8 tp10 -69.11 -50.4 48.44 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.157 0.583 . . . . 0.0 109.758 175.031 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 p 178.76 -175.89 0.22 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.526 1.53 . . . . 0.0 108.853 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ILE . . . . . 0.516 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -85.62 122.77 38.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.05 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.604 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.5 tmt_? -67.82 -56.05 10.63 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.337 1.055 . . . . 0.0 109.194 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.427 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.8 mttt -140.81 157.92 44.7 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.116 -176.984 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -139.32 143.67 37.95 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.269 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -169.04 138.1 2.1 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.902 0.751 . . . . 0.0 109.924 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -86.16 124.28 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.196 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -127.07 105.2 8.42 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.483 1.113 . . . . 0.0 109.156 -173.189 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 59.51 32.95 22.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.57 1.148 . . . . 0.0 111.087 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.92 2.65 83.85 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.588 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -107.14 111.63 24.14 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.444 0.698 . . . . 0.0 109.827 174.627 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 t -74.18 110.52 8.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -93.7 144.04 25.76 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.156 0.982 . . . . 0.0 109.386 -173.493 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' TYR . . . . . 0.516 ' HB3' HD12 ' A' ' 10' ' ' ILE . 94.6 m-85 -128.86 109.36 11.2 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.617 0.767 . . . . 0.0 109.097 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.8 tp -67.36 97.11 0.54 Allowed 'General case' 0 C--N 1.345 0.388 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.467 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.1 t -76.47 105.93 5.86 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 C-N-CA 123.768 0.827 . . . . 0.0 110.131 -173.798 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.604 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.1 tptp -82.24 100.12 9.7 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.657 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 46.2 m95 -69.04 140.64 54.94 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.8 ttpt -59.98 -50.84 72.16 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 123.585 0.553 . . . . 0.0 111.874 -172.038 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.85 -28.41 31.81 Favored Glycine 0 C--N 1.341 0.819 0 CA-C-N 115.921 -0.581 . . . . 0.0 113.343 -177.784 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.657 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 58.1 m95 -89.26 123.83 66.12 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.713 0.405 . . . . 0.0 110.147 -175.318 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' PRO . . . . . 0.481 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 72.4 Cg_exo -53.76 164.92 2.05 Favored 'Trans proline' 0 C--N 1.38 2.205 0 C-N-CA 123.645 2.897 . . . . 0.0 113.979 174.749 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.75 -23.56 33.96 Favored 'Trans proline' 0 C--N 1.387 2.584 0 C-N-CA 123.674 2.916 . . . . 0.0 114.855 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' LYS . . . . . 0.481 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.4 pttt -66.3 -33.0 74.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.227 0.611 . . . . 0.0 112.124 176.021 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.468 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 75.0 m-85 -91.35 -13.39 32.6 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.274 0.63 . . . . 0.0 111.544 176.555 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.8 m -66.92 130.77 44.23 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.338 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.0 p -119.47 145.04 46.64 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.477 0.711 . . . . 0.0 111.164 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -76.2 79.51 3.0 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.575 0.75 . . . . 0.0 110.252 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -93.18 113.67 60.64 Favored Pre-proline 0 C--O 1.236 0.373 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 175.47 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.59 178.5 4.41 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.595 1.53 . . . . 0.0 113.271 -178.967 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -38.18 -42.71 0.7 Allowed 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 127.186 2.194 . . . . 0.0 115.214 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.91 -20.67 52.44 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.517 0.727 . . . . 0.0 111.995 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -112.73 16.78 19.5 Favored 'General case' 0 C--O 1.253 1.276 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -164.809 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 32.3 mm -101.69 152.64 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 125.474 1.51 . . . . 0.0 109.213 172.92 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.41 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 91.1 mt -83.45 -73.89 0.39 Allowed 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.08 0.4 . . . . 0.0 110.817 176.094 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.79 118.3 70.02 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.0 -19.92 26.07 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.557 2.171 . . . . 0.0 112.724 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -10.08 59.25 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.326 178.131 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -49.14 -42.04 38.25 Favored 'General case' 0 N--CA 1.507 2.392 0 CA-C-N 119.248 0.931 . . . . 0.0 110.412 167.489 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -51.57 57.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.918 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mmt -55.27 -42.36 73.46 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.856 0.862 . . . . 0.0 111.49 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' ALA . . . . . 0.47 ' HB1' ' O ' ' B' ' 19' ' ' GLN . . . -66.65 -39.43 88.22 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.871 1.268 . . . . 0.0 111.339 -175.892 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.68 -46.76 35.76 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.47 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 55' ' ' GLU . 62.5 mt-10 -68.71 -6.3 25.46 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.449 0.7 . . . . 0.0 112.793 -170.957 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -63.08 -18.14 63.06 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.524 0.73 . . . . 0.0 112.006 168.78 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -79.87 -49.77 11.46 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.221 0.608 . . . . 0.0 110.324 177.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' GLU . . . . . 0.417 ' HG2' ' HA ' ' A' ' 52' ' ' GLU . 11.9 pt-20 -77.89 159.8 28.67 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.258 0.623 . . . . 0.0 110.101 177.144 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.549 -0.738 . . . . 0.0 109.408 -177.284 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 19' ' ' GLN . . . . . 0.47 ' O ' ' HB1' ' A' ' 50' ' ' ALA . 58.8 tp60 . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 42.1 mt -69.62 104.23 2.32 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 171.167 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 21' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' B' ' 23' ' ' LYS . . . -134.3 140.87 46.7 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.093 0.957 . . . . 0.0 109.611 -174.672 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 52.4 p -75.46 106.89 7.24 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.65 0.78 . . . . 0.0 110.571 -175.336 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 23' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' B' ' 21' ' ' ALA . 22.8 mtpp -118.21 -165.92 1.16 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.389 1.076 . . . . 0.0 110.081 -174.123 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.18 125.77 53.8 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.31 0.644 . . . . 0.0 110.117 174.202 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.59 175.51 9.1 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 124.189 0.996 . . . . 0.0 108.508 171.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.494 ' HD2' ' HG3' ' A' ' 2' ' ' GLU . 45.0 ttp180 -144.85 150.1 36.53 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.065 0.546 . . . . 0.0 110.706 -173.455 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 27' ' ' M3L . . . . . 0.484 HM23 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.241 0.652 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 165.236 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 42.3 t -76.78 82.95 3.38 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.93 142.69 90.97 Favored Pre-proline 0 CA--C 1.549 0.926 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.029 -171.386 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.96 156.88 52.0 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.662 2.241 . . . . 0.0 112.308 177.136 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.3 -54.51 5.42 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.283 0.633 . . . . 0.0 109.46 175.573 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 44.3 p -124.82 -32.19 3.09 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.489 1.115 . . . . 0.0 110.218 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.528 0 CA-C-O 118.866 -0.963 . . . . 0.0 112.67 -173.525 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.597 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -87.99 134.29 33.76 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.234 1.014 . . . . 0.0 109.453 -172.793 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -64.33 116.79 6.4 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.343 1.057 . . . . 0.0 113.196 -163.038 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.3 t -116.67 140.8 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.963 1.305 . . . . 0.0 108.584 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -141.31 158.63 43.63 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.53 0.732 . . . . 0.0 110.373 171.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.75 114.87 11.36 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.588 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -87.27 138.76 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.345 1.058 . . . . 0.0 110.249 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -76.28 -57.4 3.89 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 122.922 0.489 . . . . 0.0 109.821 175.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.0 m -157.16 170.95 21.33 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.013 0.925 . . . . 0.0 110.16 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.2 mm -89.28 110.9 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 162.992 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.516 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.6 tmt_? -66.37 -58.46 5.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.348 1.059 . . . . 0.0 109.198 -177.846 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 12' ' ' LYS . . . . . 0.492 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.5 mtpp -137.58 170.88 15.31 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.774 0.83 . . . . 0.0 111.444 -177.68 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -156.68 129.4 7.7 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.432 1.093 . . . . 0.0 108.898 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -157.84 150.72 22.94 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.682 0.793 . . . . 0.0 109.235 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 20' ' ' VAL . 47.2 t -93.43 112.68 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 173.341 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -107.2 96.83 6.7 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.761 1.224 . . . . 0.0 108.751 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.3 tptt 62.11 49.28 4.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.645 1.178 . . . . 0.0 110.938 176.932 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 81.82 -18.28 12.94 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.677 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -86.68 110.54 19.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.005 0.922 . . . . 0.0 109.57 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 15' ' ' VAL . 21.4 t -78.71 103.75 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -98.41 144.95 27.22 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.235 1.014 . . . . 0.0 110.554 -173.546 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -126.32 119.92 28.59 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.089 0.956 . . . . 0.0 108.602 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.3 tp -70.72 90.81 0.79 Allowed 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 169.615 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.531 HG21 HD11 ' A' ' 42' ' ' ILE . 63.7 t -78.02 105.26 6.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 123.697 0.799 . . . . 0.0 109.95 -173.545 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.4 tptp -77.41 103.55 7.4 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.45 0.7 . . . . 0.0 109.14 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' TRP . . . . . 0.498 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -77.04 157.32 31.2 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 110.111 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -64.55 -41.98 95.98 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.931 0.492 . . . . 0.0 111.098 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.0 -24.39 35.08 Favored Glycine 0 C--N 1.346 1.098 0 CA-C-N 115.935 -0.575 . . . . 0.0 113.597 -177.152 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' TRP . . . . . 0.498 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 77.0 m95 -104.45 124.59 36.67 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 122.906 0.482 . . . . 0.0 111.055 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -52.98 163.66 1.99 Allowed 'Trans proline' 0 C--N 1.386 2.524 0 C-N-CA 124.056 3.17 . . . . 0.0 113.363 171.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -62.84 -26.64 74.77 Favored 'Trans proline' 0 C--N 1.385 2.497 0 C-N-CA 123.08 2.52 . . . . 0.0 113.448 -174.827 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -78.47 -26.25 46.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.069 0.548 . . . . 0.0 111.278 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' TYR . . . . . 0.402 ' HB3' ' HE3' ' A' ' 29' ' ' TRP . 87.3 m-85 -92.75 2.11 56.92 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.838 0.855 . . . . 0.0 111.391 175.041 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.0 m -76.3 155.73 34.0 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.369 0.667 . . . . 0.0 110.347 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.3 p -115.35 135.43 54.14 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.258 0.623 . . . . 0.0 112.481 -171.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -74.95 82.49 2.2 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.91 0.884 . . . . 0.0 110.286 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -106.06 123.07 40.26 Favored Pre-proline 0 N--CA 1.465 0.299 0 C-N-CA 123.751 0.82 . . . . 0.0 109.432 178.326 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' PRO . . . . . 0.535 ' O ' HG12 ' A' ' 42' ' ' ILE . 38.3 Cg_endo -64.19 165.05 20.6 Favored 'Trans proline' 0 C--N 1.368 1.6 0 C-N-CA 122.361 2.04 . . . . 0.0 112.15 173.393 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -56.43 -27.92 57.97 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.192 0.997 . . . . 0.0 111.021 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -55.5 -45.26 77.06 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.604 1.561 . . . . 0.0 111.226 169.514 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' HIS . . . . . 0.418 ' HE1' ' HG3' ' B' ' 30' ' ' PRO . 42.5 m170 -88.13 -7.29 57.15 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.066 0.946 . . . . 0.0 113.169 -176.177 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' ILE . . . . . 0.65 HD12 ' HB1' ' B' ' 25' ' ' ALA . 41.8 mm -94.26 139.22 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.814 0.846 . . . . 0.0 109.833 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' LEU . . . . . 0.579 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 94.9 mt -71.48 -64.76 0.86 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.833 0.453 . . . . 0.0 110.078 175.941 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.69 109.99 22.04 Favored Pre-proline 0 CA--C 1.556 1.184 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.161 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.8 -9.89 19.78 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.782 2.321 . . . . 0.0 112.704 -176.281 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 -72.89 -12.63 61.04 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.311 0.644 . . . . 0.0 111.341 -176.906 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.89 -43.38 86.07 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.914 0.486 . . . . 0.0 110.975 169.134 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.6 t -64.81 -42.05 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.693 0.797 . . . . 0.0 109.938 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' MET . . . . . 0.401 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 24.7 mmt -60.36 -47.49 85.81 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.276 177.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.9 80.4 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.507 1.123 . . . . 0.0 111.565 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' TYR . . . . . 0.429 ' O ' ' HG3' ' A' ' 54' ' ' LYS . 87.7 t80 -68.08 -34.08 75.75 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.89 0.876 . . . . 0.0 110.774 176.005 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -90.79 -9.06 47.95 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.932 0.493 . . . . 0.0 111.881 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 49' ' ' MET . 30.0 mm-40 -64.82 -42.98 94.55 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.933 0.493 . . . . 0.0 110.02 171.456 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -80.14 -35.71 36.24 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.993 175.269 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -67.52 143.64 56.05 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.193 0.597 . . . . 0.0 110.065 -175.39 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 . . . . . 0 CA--C 1.556 1.178 0 C-N-CA 123.28 0.632 . . . . 0.0 110.014 -176.096 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 . . . . . 0 C--O 1.242 0.697 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 8.7 tt -80.57 128.94 34.18 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.5 88.33 0.21 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.614 0.766 . . . . 0.0 110.306 -179.199 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 17.4 m -80.9 77.47 7.78 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.939 0.876 . . . . 0.0 110.834 -172.297 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.09 173.6 11.06 Favored 'General case' 0 C--O 1.248 0.991 0 C-N-CA 125.346 1.458 . . . . 0.0 107.539 170.195 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -113.76 112.02 22.73 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.423 0.63 . . . . 0.0 110.63 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 25' ' ' ALA . . . . . 0.65 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -85.87 168.94 13.77 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.464 165.656 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 26' ' ' ARG . . . . . 0.579 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 23.1 ttt180 -140.47 149.66 42.81 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.488 0.661 . . . . 0.0 111.289 -175.096 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.717 0 N-CA-C 107.778 -1.194 . . . . 0.0 107.778 166.143 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.9 t -64.95 112.83 3.48 Favored 'General case' 0 C--N 1.356 0.879 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.73 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.93 121.67 77.07 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.252 1.021 . . . . 0.0 110.922 -170.028 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 30' ' ' PRO . . . . . 0.418 ' HG3' ' HE1' ' A' ' 41' ' ' HIS . 7.5 Cg_exo -70.71 124.0 10.3 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.488 2.125 . . . . 0.0 110.839 174.955 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.33 106.02 0.69 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.489 0.716 . . . . 0.0 109.507 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 60.6 p 56.52 18.37 3.51 Favored 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 125.737 1.615 . . . . 0.0 112.854 -175.889 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.03 0 CA-C-O 119.229 -0.762 . . . . 0.0 111.741 -179.413 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . 0.425 ' HB3' ' HE2' ' A' ' 5' ' ' PHE . 1.3 mp0 . . . . . 0 CA--C 1.543 0.7 0 CA-C-O 121.211 0.529 . . . . 0.0 109.593 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 71.3 t -82.51 120.8 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 109.622 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.425 ' HE2' ' HB3' ' A' ' 3' ' ' GLN . 86.8 m-85 -137.14 161.91 34.85 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.736 0.814 . . . . 0.0 109.676 178.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.89 129.87 37.64 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 174.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.419 HG13 HD11 ' A' ' 47' ' ' LEU . 2.7 p -111.25 143.11 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.507 1.123 . . . . 0.0 110.418 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.0 -58.99 2.96 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.468 1.107 . . . . 0.0 109.378 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.9 p -174.14 -172.28 0.69 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.402 1.081 . . . . 0.0 109.775 -176.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.444 HD12 ' HB3' ' A' ' 22' ' ' TYR . 48.2 mm -98.01 120.07 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -73.68 -53.93 9.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.127 0.971 . . . . 0.0 109.552 179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.476 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 99.0 mttt -138.05 174.45 10.55 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.916 0.886 . . . . 0.0 111.342 -176.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -154.55 144.79 21.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.35 1.06 . . . . 0.0 108.724 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -161.45 -179.2 7.16 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.984 0.914 . . . . 0.0 109.538 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 41.2 t -135.14 118.76 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -136.83 129.85 30.95 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.333 1.053 . . . . 0.0 109.274 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm 62.68 24.92 14.84 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.994 0.918 . . . . 0.0 111.63 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.04 -8.44 60.42 Favored Glycine 0 C--N 1.352 1.424 0 CA-C-N 115.816 -0.629 . . . . 0.0 113.232 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -85.87 117.99 25.07 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 123.84 0.856 . . . . 0.0 108.935 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.7 t -79.09 104.8 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -97.68 139.08 34.11 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.946 0.898 . . . . 0.0 110.139 -170.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.444 ' HB3' HD12 ' A' ' 10' ' ' ILE . 15.1 m-85 -118.13 121.3 40.18 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.452 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 28.0 tp -74.8 94.64 2.79 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 172.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.8 t -76.69 105.98 6.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.622 0.769 . . . . 0.0 109.97 -174.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.491 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.0 tptp -81.65 106.92 13.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.621 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 77.4 m95 -77.16 149.97 35.56 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.571 0.748 . . . . 0.0 110.787 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -77.44 -34.06 54.63 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.076 0.55 . . . . 0.0 111.322 -174.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.51 15.31 42.13 Favored Glycine 0 C--N 1.343 0.944 0 CA-C-N 116.229 -0.442 . . . . 0.0 113.008 -178.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.621 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 88.8 m95 -133.48 136.83 27.69 Favored Pre-proline 0 C--O 1.246 0.887 0 C-N-CA 123.125 0.57 . . . . 0.0 110.067 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.443 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 88.4 Cg_exo -52.21 158.05 5.72 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 123.355 2.704 . . . . 0.0 113.333 167.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.42 5.54 1.53 Allowed 'Trans proline' 0 C--N 1.377 2.049 0 C-N-CA 123.406 2.737 . . . . 0.0 114.603 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.443 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.0 pttt -90.03 -15.88 30.91 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.779 0.431 . . . . 0.0 110.923 170.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 97.7 m-85 -96.32 -2.6 45.47 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.54 0.736 . . . . 0.0 111.441 174.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -63.53 122.52 16.49 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.069 0.547 . . . . 0.0 110.727 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.8 p -102.43 135.91 43.21 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.74 0.816 . . . . 0.0 111.366 -172.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -76.33 75.37 3.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.276 0.63 . . . . 0.0 109.494 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -90.65 117.95 68.33 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.19 169.16 15.78 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 121.996 1.797 . . . . 0.0 111.756 173.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -50.11 -39.41 42.78 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.985 1.314 . . . . 0.0 114.378 -171.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.78 -1.47 54.33 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.401 ' O ' ' HG3' ' B' ' 26' ' ' ARG . 27.3 m-70 -115.72 14.19 16.35 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.881 0.873 . . . . 0.0 111.236 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 28.9 mm -103.42 150.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 126.11 1.764 . . . . 0.0 109.541 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.435 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 5.6 tt -89.44 -79.47 0.33 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.41 ' O ' HD23 ' A' ' 47' ' ' LEU . 13.3 t70 -80.66 126.63 77.71 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -80.45 -13.7 12.07 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.755 2.304 . . . . 0.0 114.247 -175.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -15.11 62.74 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.387 0.675 . . . . 0.0 112.74 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.419 HD11 HG13 ' A' ' 7' ' ' VAL . 3.9 mm? -58.42 -53.27 60.19 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 118.335 0.516 . . . . 0.0 111.715 178.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.14 -32.53 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.876 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.497 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmt -62.4 -52.34 63.97 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 175.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.25 72.24 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.494 1.118 . . . . 0.0 111.58 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -62.82 -47.37 83.71 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.206 1.003 . . . . 0.0 110.928 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.34 -9.9 59.29 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 49' ' ' MET . 27.3 mm-40 . . . . . 0 N--CA 1.482 1.153 0 CA-C-O 120.942 0.401 . . . . 0.0 110.447 169.938 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.0 mptt . . . . . 0 C--O 1.238 0.476 0 N-CA-C 109.395 -0.595 . . . . 0.0 109.395 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -130.15 127.4 39.67 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.076 0.951 . . . . 0.0 108.824 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.91 -174.0 2.36 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . 0.435 ' HG2' ' HB2' ' A' ' 43' ' ' LEU . 9.7 ptp180 . . . . . 0 N--CA 1.47 0.558 0 C-N-CA 123.47 0.708 . . . . 0.0 109.837 -176.162 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 . . . . . 0 CA--C 1.541 0.611 0 CA-C-O 121.133 0.492 . . . . 0.0 109.686 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 t -109.68 144.32 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 124.273 1.029 . . . . 0.0 108.612 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.548 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 72.8 m-85 -128.97 160.73 31.77 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 167.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.48 114.13 10.27 Favored 'General case' 0 C--O 1.242 0.673 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 166.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.414 HG12 ' O ' ' B' ' 23' ' ' LYS . 3.1 p -92.95 137.88 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.083 0.553 . . . . 0.0 111.331 -172.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.653 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.8 tt0 -63.12 -59.56 4.61 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.714 0.806 . . . . 0.0 109.496 174.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.3 p -176.73 176.53 1.5 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-N 113.621 -1.627 . . . . 0.0 108.844 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.522 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.4 mm -82.95 115.6 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -53.56 18.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.184 0.594 . . . . 0.0 110.279 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -133.96 166.32 22.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.565 0.746 . . . . 0.0 110.566 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -151.06 142.2 23.15 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -154.42 173.23 16.52 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.447 0.699 . . . . 0.0 109.318 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.03 125.03 9.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.3 ptt180 -139.9 122.22 15.99 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.651 0.78 . . . . 0.0 109.296 178.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 62.62 26.45 15.68 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.853 1.261 . . . . 0.0 110.667 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.46 -8.01 80.49 Favored Glycine 0 C--N 1.354 1.543 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.712 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 70.2 mmtt -89.77 112.96 24.42 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 117.252 0.526 . . . . 0.0 110.858 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.2 t -89.36 108.33 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.37 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -96.76 155.73 16.65 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.243 0.617 . . . . 0.0 110.738 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.522 ' HB3' HD12 ' A' ' 10' ' ' ILE . 66.2 m-85 -132.99 112.22 11.66 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.142 0.977 . . . . 0.0 108.693 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.26 90.58 0.5 Allowed 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.26 106.91 4.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.521 0.728 . . . . 0.0 111.305 -173.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -82.8 107.25 15.29 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 52.9 m95 -71.45 149.25 46.06 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.853 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.653 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 26.7 ttpp -67.48 -65.43 0.69 Allowed 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.319 0.648 . . . . 0.0 112.614 -166.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.21 41.07 2.72 Favored Glycine 0 N--CA 1.467 0.763 0 CA-C-N 116.583 -0.28 . . . . 0.0 112.759 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.512 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.7 m95 -139.57 133.97 16.03 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 123.715 0.806 . . . . 0.0 109.385 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -59.71 157.31 33.22 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 122.775 2.317 . . . . 0.0 112.374 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.55 -15.23 19.32 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 124.046 3.164 . . . . 0.0 115.328 -172.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.52 -25.19 67.88 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -87.39 -5.1 59.0 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.463 0.705 . . . . 0.0 112.619 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.1 p -66.6 125.83 27.0 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 21.4 p -118.36 135.91 54.05 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.692 0.797 . . . . 0.0 110.904 -173.239 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -68.81 85.4 0.32 Allowed 'General case' 0 C--N 1.356 0.874 0 C-N-CA 123.276 0.63 . . . . 0.0 109.389 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -100.64 102.83 20.63 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -62.91 178.92 0.86 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 122.513 2.142 . . . . 0.0 113.234 173.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -59.13 -24.19 62.79 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.8 mp0 -73.84 -23.18 59.6 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.175 0.59 . . . . 0.0 111.979 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -94.56 -19.27 20.65 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -168.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.46 HG23 ' HA ' ' B' ' 25' ' ' ALA . 33.2 mm -90.81 149.36 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.76 0.824 . . . . 0.0 110.613 -174.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -86.34 -71.94 0.52 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.214 0.606 . . . . 0.0 109.617 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -72.03 126.68 91.2 Favored Pre-proline 0 CA--C 1.562 1.407 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -76.43 -23.23 11.71 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.575 2.183 . . . . 0.0 113.796 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.405 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 88.8 mtm180 -69.87 -12.83 61.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.33 1.052 . . . . 0.0 113.59 -168.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.438 ' HB3' HG12 ' A' ' 10' ' ' ILE . 3.0 mm? -57.31 -40.63 78.26 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 118.116 0.416 . . . . 0.0 110.693 171.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.63 -43.95 93.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.059 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.426 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 1.5 mpt? -61.95 -50.58 71.56 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.589 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.32 -34.97 74.55 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.283 1.033 . . . . 0.0 111.797 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.34 -39.69 94.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.039 0.936 . . . . 0.0 110.926 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -87.15 -10.68 52.1 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.735 0.814 . . . . 0.0 111.942 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' MET . 41.0 mm-40 . . . . . 0 N--CA 1.482 1.17 0 C-N-CA 122.856 0.463 . . . . 0.0 110.785 175.025 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . 0.414 ' O ' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER . . . . . 0 C--O 1.247 0.97 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 . . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -102.03 104.3 14.95 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.164 0.506 . . . . 0.0 110.647 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.46 ' HA ' HG23 ' A' ' 42' ' ' ILE . . . -103.85 142.34 34.57 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 164.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 . . . . . 0 N--CA 1.469 0.505 0 C-N-CA 123.104 0.561 . . . . 0.0 110.092 -172.537 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 83.8 mt-30 . . . . . 0 N--CA 1.48 1.043 0 CA-C-O 121.219 0.533 . . . . 0.0 110.635 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 46.0 t -83.65 125.01 40.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.482 1.113 . . . . 0.0 109.512 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.401 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 68.8 m-85 -133.44 147.01 51.68 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.937 0.495 . . . . 0.0 110.421 176.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.66 111.32 4.73 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.1 p -89.37 144.14 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.685 0.794 . . . . 0.0 110.736 -176.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -81.92 -61.19 1.99 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.739 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.6 m -158.35 171.58 19.91 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.937 0.895 . . . . 0.0 110.221 -174.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.468 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 34.7 mm -92.81 117.5 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 163.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.01 -46.91 27.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.944 0.898 . . . . 0.0 109.887 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -151.65 166.1 32.3 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.532 0.733 . . . . 0.0 109.765 -176.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -146.97 152.21 38.26 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.242 1.017 . . . . 0.0 109.68 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -165.15 167.69 17.91 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.367 1.467 . . . . 0.0 108.526 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 13.6 p -118.42 145.35 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 172.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -142.81 96.02 2.87 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.178 0.591 . . . . 0.0 109.602 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm 55.96 39.19 30.58 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.546 1.138 . . . . 0.0 111.554 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.48 -19.51 52.2 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.752 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -85.75 108.29 18.01 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 11.3 t -85.9 109.77 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -175.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -93.82 136.53 34.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.896 0.878 . . . . 0.0 109.657 -170.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -124.48 122.79 38.61 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -71.63 85.87 0.89 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 170.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.614 HG21 HD11 ' A' ' 42' ' ' ILE . 65.8 t -77.43 107.03 8.35 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.741 -173.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -74.54 102.84 4.65 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.604 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.7 m95 -74.18 138.0 43.49 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.498 177.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -77.95 -17.9 56.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.008 0.523 . . . . 0.0 111.35 -172.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.37 13.76 28.08 Favored Glycine 0 C--N 1.346 1.116 0 C-N-CA 123.107 0.384 . . . . 0.0 112.994 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.604 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.2 m95 -130.88 147.16 65.14 Favored Pre-proline 0 N--CA 1.482 1.173 0 C-N-CA 123.592 0.757 . . . . 0.0 110.537 178.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -55.13 157.26 14.12 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.212 2.608 . . . . 0.0 113.254 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -63.92 -16.74 56.6 Favored 'Trans proline' 0 C--N 1.384 2.409 0 C-N-CA 123.122 2.548 . . . . 0.0 113.338 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.67 -27.94 30.98 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.009 0.524 . . . . 0.0 111.465 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -86.76 -1.43 57.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.628 0.771 . . . . 0.0 111.174 175.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.6 m -67.11 117.99 9.91 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 170.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.0 p -106.58 151.66 24.73 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.361 0.664 . . . . 0.0 111.269 -172.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -79.19 89.28 4.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.281 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -100.45 119.1 59.76 Favored Pre-proline 0 C--O 1.239 0.53 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -69.46 171.23 14.5 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.296 1.998 . . . . 0.0 112.073 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -61.9 -19.45 62.68 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.654 0.782 . . . . 0.0 112.13 177.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -56.88 -46.59 81.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.993 0.917 . . . . 0.0 110.224 168.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.8 m170 -85.47 -25.23 27.03 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.666 -172.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.614 HD11 HG21 ' A' ' 24' ' ' VAL . 48.1 mm -81.84 146.21 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.599 0.76 . . . . 0.0 111.624 -174.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.1 mt -86.47 -61.92 1.63 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.678 0.791 . . . . 0.0 110.098 173.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -72.55 112.68 15.93 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 123.397 0.679 . . . . 0.0 110.161 -172.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.49 -24.49 7.59 Favored 'Trans proline' 0 C--N 1.374 1.873 0 C-N-CA 122.582 2.188 . . . . 0.0 112.582 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -72.89 -21.15 60.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.271 1.028 . . . . 0.0 109.71 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 44.5 tp -55.22 -48.64 73.6 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.354 1.461 . . . . 0.0 112.234 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t -68.92 -36.03 72.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.216 -177.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.402 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 92.6 mmm -55.86 -45.51 78.48 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.086 0.866 . . . . 0.0 110.666 178.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.58 -33.43 63.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.964 0.905 . . . . 0.0 112.454 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.468 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 86.1 t80 -75.44 -46.03 35.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.113 0.965 . . . . 0.0 110.389 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.53 -11.89 61.1 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.652 0.781 . . . . 0.0 112.899 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 49' ' ' MET . 11.0 mm-40 . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 121.323 0.582 . . . . 0.0 109.821 172.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtpt . . . . . 0 N--CA 1.476 0.848 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -119.91 113.09 20.03 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 122.897 0.479 . . . . 0.0 110.232 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.463 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -96.4 172.66 7.8 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 169.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 49.7 ttp180 . . . . . 0 N--CA 1.467 0.386 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 -175.426 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 . . . . . 0 CA--C 1.551 1.018 0 CA-C-O 121.112 0.482 . . . . 0.0 112.174 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.9 t -102.15 121.36 53.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 125.022 1.329 . . . . 0.0 107.978 172.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.427 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 52.4 m-85 -127.13 155.09 43.89 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 118.065 0.393 . . . . 0.0 110.338 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.97 114.75 6.78 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.464 HG13 HD11 ' A' ' 47' ' ' LEU . 4.1 p -103.97 137.52 32.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 C-N-CA 124.116 0.967 . . . . 0.0 111.073 -173.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 32.0 tt0 -74.87 -63.03 1.35 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.924 -177.554 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -165.48 -177.65 4.54 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.941 0.896 . . . . 0.0 110.385 -173.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.55 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.9 mm -86.95 109.68 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 169.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.628 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -68.76 -49.62 57.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.848 1.259 . . . . 0.0 109.408 -178.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -146.03 168.96 19.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.407 1.083 . . . . 0.0 109.788 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -155.18 138.73 15.97 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.969 0.908 . . . . 0.0 108.897 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -165.56 139.78 4.7 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.64 0.776 . . . . 0.0 109.714 174.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.97 118.63 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 CA-C-O 121.256 0.55 . . . . 0.0 110.625 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -107.53 101.3 10.64 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.022 0.929 . . . . 0.0 109.615 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 59.45 40.96 20.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.065 1.346 . . . . 0.0 112.642 174.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.81 -17.64 57.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-N 115.533 -0.758 . . . . 0.0 113.232 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -90.49 110.92 22.03 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.3 t -81.82 111.4 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -93.78 137.94 32.5 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 123.913 0.885 . . . . 0.0 109.474 -173.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.55 ' HB3' HD12 ' A' ' 10' ' ' ILE . 72.6 m-85 -121.61 114.73 21.59 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.54 HD23 ' HD2' ' A' ' 11' ' ' ARG . 23.6 tp -70.55 93.62 0.92 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 170.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 73.5 t -70.73 105.84 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 124.659 1.184 . . . . 0.0 110.571 -175.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 21.0 tptm -78.63 101.06 7.27 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 172.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.504 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 74.1 m95 -69.09 141.23 54.78 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 173.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -76.65 -39.56 51.86 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.95 -47.96 35.89 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.212 178.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.504 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.9 m95 -87.24 136.31 33.76 Favored Pre-proline 0 N--CA 1.479 0.994 0 C-N-CA 123.455 0.702 . . . . 0.0 110.491 -177.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -60.42 164.05 13.83 Favored 'Trans proline' 0 CA--C 1.569 2.262 0 C-N-CA 123.081 2.521 . . . . 0.0 112.034 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.53 -19.33 13.41 Favored 'Trans proline' 0 C--N 1.39 2.744 0 C-N-CA 124.059 3.173 . . . . 0.0 115.562 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -71.58 -27.51 63.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.634 0.374 . . . . 0.0 111.991 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.424 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 67.6 m-85 -97.19 12.39 33.0 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.425 0.69 . . . . 0.0 111.857 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -64.77 122.77 17.67 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 173.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.7 p -101.55 128.8 47.63 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.877 0.871 . . . . 0.0 111.005 -173.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -68.8 83.49 0.3 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 171.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 41' ' ' HIS . 29.0 mm-40 -106.85 116.82 58.07 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.1 174.96 5.23 Favored 'Trans proline' 0 C--N 1.362 1.243 0 C-N-CA 122.064 1.843 . . . . 0.0 111.421 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -56.84 -19.07 15.44 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.495 1.118 . . . . 0.0 112.858 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.73 -22.89 62.68 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.127 1.371 . . . . 0.0 112.078 173.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . 0.498 ' HB2' ' HB3' ' A' ' 37' ' ' GLU . 66.8 m-70 -117.04 -16.47 10.48 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.149 0.98 . . . . 0.0 112.176 -174.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mm -82.26 140.92 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 122.905 0.482 . . . . 0.0 110.626 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.5 mt -87.91 -70.73 0.61 Allowed 'General case' 0 C--N 1.351 0.655 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -72.73 126.63 90.59 Favored Pre-proline 0 CA--C 1.557 1.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -80.13 -17.6 10.45 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.865 2.377 . . . . 0.0 113.828 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.643 ' HA ' ' HG2' ' A' ' 49' ' ' MET . 87.1 mtm180 -69.82 -16.38 63.26 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.247 0.619 . . . . 0.0 111.887 -173.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.464 HD11 HG13 ' A' ' 7' ' ' VAL . 4.3 mm? -58.02 -53.75 54.68 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.346 0.658 . . . . 0.0 110.457 172.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.7 t -70.69 -53.06 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 114.515 -1.221 . . . . 0.0 109.85 -171.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.643 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 25.6 ptm -59.18 -33.34 70.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.722 0.639 . . . . 0.0 112.086 -174.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.97 -49.56 74.24 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -66.13 -30.95 71.54 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.004 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -74.97 -18.88 60.31 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.788 0.835 . . . . 0.0 111.586 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 . . . . . 0 N--CA 1.476 0.826 0 C-N-CA 122.94 0.496 . . . . 0.0 111.544 173.666 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER . . . . . 0 C--O 1.243 0.76 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -127.55 123.8 36.68 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 111.297 -176.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.92 168.42 10.31 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 167.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 . . . . . 0 C--N 1.319 -0.754 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -176.007 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 . . . . . 0 N--CA 1.485 1.302 0 CA-C-O 120.873 0.368 . . . . 0.0 110.538 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 47.9 t -133.85 128.24 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 167.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.418 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 63.6 m-85 -138.07 166.8 23.21 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.224 0.61 . . . . 0.0 109.84 175.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.92 151.38 44.76 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.42 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.485 HG13 HD11 ' A' ' 47' ' ' LEU . 2.5 p -138.49 133.41 42.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 C-N-CA 124.097 0.959 . . . . 0.0 109.479 -176.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 10.7 tp10 -72.64 -50.5 24.77 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.91 178.404 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 p -174.25 175.36 2.68 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 124.336 1.054 . . . . 0.0 110.047 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.592 HD12 ' HB3' ' A' ' 22' ' ' TYR . 40.2 mm -78.67 116.9 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 168.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -64.61 -56.24 15.14 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 124.306 1.042 . . . . 0.0 109.179 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -141.26 165.94 26.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.11 0.964 . . . . 0.0 110.195 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -146.62 139.19 25.12 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.652 0.781 . . . . 0.0 109.71 -173.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -157.34 170.9 21.42 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.866 1.266 . . . . 0.0 108.49 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 t -129.16 132.88 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 118.665 0.666 . . . . 0.0 109.627 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.417 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 66.4 ttt180 -144.15 122.89 12.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.546 0.739 . . . . 0.0 109.231 -177.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.417 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 93.1 mttt 65.24 26.63 12.25 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.752 1.221 . . . . 0.0 111.76 176.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.85 -10.8 72.54 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.866 -176.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -98.79 115.12 28.08 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.844 0.858 . . . . 0.0 110.471 -176.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.4 112.09 14.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -92.23 143.44 26.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.187 0.995 . . . . 0.0 109.679 -175.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.592 ' HB3' HD12 ' A' ' 10' ' ' ILE . 66.8 m-85 -129.96 117.54 20.25 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.0 tp -68.63 89.09 0.36 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 172.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.557 HG21 HD11 ' A' ' 42' ' ' ILE . 97.4 t -74.65 107.89 5.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.627 0 C-N-CA 123.594 0.758 . . . . 0.0 110.526 -174.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -79.45 100.25 7.59 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.543 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 80.1 m95 -68.19 127.42 32.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.071 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -64.8 -41.18 96.01 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.985 0.914 . . . . 0.0 112.027 -166.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.43 18.81 52.97 Favored Glycine 0 N--CA 1.474 1.231 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.578 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.543 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 87.9 m95 -129.79 140.7 39.43 Favored Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 123.798 0.839 . . . . 0.0 109.861 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.435 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 80.1 Cg_exo -51.91 154.33 10.24 Favored 'Trans proline' 0 C--N 1.382 2.315 0 C-N-CA 123.544 2.829 . . . . 0.0 113.989 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -53.65 -24.19 28.75 Favored 'Trans proline' 0 C--N 1.386 2.514 0 C-N-CA 123.949 3.1 . . . . 0.0 114.841 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.435 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 58.6 pttt -66.42 -28.55 68.7 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 122.675 0.39 . . . . 0.0 111.471 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -88.94 2.38 53.95 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.352 0.661 . . . . 0.0 112.15 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.7 p -67.3 117.32 9.15 Favored 'General case' 0 C--N 1.356 0.883 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.3 p -108.22 136.42 47.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.859 0.864 . . . . 0.0 110.506 -173.907 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -69.89 80.62 0.46 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.413 0.685 . . . . 0.0 110.173 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.503 ' HB2' HD11 ' A' ' 42' ' ' ILE . 15.4 mm-40 -94.67 116.0 65.92 Favored Pre-proline 0 C--O 1.239 0.508 0 C-N-CA 123.63 0.772 . . . . 0.0 109.025 177.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -66.0 172.19 8.91 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 121.992 1.795 . . . . 0.0 112.19 172.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -54.13 -28.67 41.3 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.687 1.195 . . . . 0.0 112.355 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -59.66 -34.81 73.32 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.185 1.394 . . . . 0.0 111.709 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.4 m170 -85.05 -31.55 23.35 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.507 -173.763 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.557 HD11 HG21 ' A' ' 24' ' ' VAL . 36.9 mm -86.62 144.49 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 124.061 0.944 . . . . 0.0 111.666 -167.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.07 -72.14 0.38 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.543 0.737 . . . . 0.0 110.513 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.33 117.75 64.31 Favored Pre-proline 0 CA--C 1.557 1.227 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -78.3 -15.91 14.0 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.427 2.085 . . . . 0.0 112.893 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -72.76 -12.45 61.01 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 111.981 -173.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.485 HD11 HG13 ' A' ' 7' ' ' VAL . 3.1 mm? -50.95 -45.06 60.55 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 123.048 0.539 . . . . 0.0 110.885 168.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.4 t -61.24 -49.88 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.387 -176.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -68.83 -37.24 79.04 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.089 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.53 93.87 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.833 0.853 . . . . 0.0 111.017 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.473 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 18.8 t80 -61.92 -53.29 57.82 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.857 0.863 . . . . 0.0 110.667 174.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.8 -36.85 76.03 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.4 -170.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 . . . . . 0 N--CA 1.489 1.519 0 CA-C-N 118.097 0.408 . . . . 0.0 111.296 -178.686 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . 0.44 ' HB3' HD21 ' A' ' 47' ' ' LEU . 1.3 mptm? . . . . . 0 C--O 1.241 0.619 0 CA-C-O 121.369 0.604 . . . . 0.0 111.035 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.37 112.81 22.03 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.138 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.542 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.41 168.67 10.25 Favored 'General case' 0 C--O 1.245 0.841 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 169.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 17.7 ttt180 . . . . . 0 C--N 1.327 -0.399 0 C-N-CA 122.92 0.488 . . . . 0.0 110.101 -169.525 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.8 mp0 . . . . . 0 N--CA 1.476 0.85 0 CA-C-O 120.82 0.343 . . . . 0.0 110.772 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.8 t -103.05 127.71 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.348 1.059 . . . . 0.0 108.729 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.456 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 76.1 m-85 -138.87 158.04 44.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.368 0.667 . . . . 0.0 109.868 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.93 101.11 5.06 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 171.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -72.14 139.57 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.186 0.994 . . . . 0.0 110.996 -175.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 28.4 tt0 -73.11 -51.79 16.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.62 0.768 . . . . 0.0 109.907 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.9 p -175.07 -175.84 0.89 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.054 1.341 . . . . 0.0 109.403 175.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.503 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 42.9 mm -97.65 117.65 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 169.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.5 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.1 tmt_? -74.1 -58.07 3.54 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.5 1.12 . . . . 0.0 109.594 -177.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.3 mttm -136.72 178.83 6.77 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.8 0.84 . . . . 0.0 111.011 -176.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.443 ' HE3' HG11 ' A' ' 20' ' ' VAL . 86.1 tttt -158.42 147.57 19.17 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.51 1.124 . . . . 0.0 108.917 -175.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -164.03 143.81 8.03 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.995 0.918 . . . . 0.0 109.369 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.1 p -88.05 141.65 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.483 ' HA ' ' HE ' ' A' ' 16' ' ' ARG . 2.3 tpm_? -142.31 99.17 3.45 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.843 0.857 . . . . 0.0 108.747 -174.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 60.39 29.81 19.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.382 1.073 . . . . 0.0 111.487 -176.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.82 -17.35 58.85 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-N 116.264 -0.426 . . . . 0.0 113.417 -175.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.49 111.59 22.0 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.266 0.626 . . . . 0.0 110.067 177.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.443 HG11 ' HE3' ' A' ' 13' ' ' LYS . 50.6 t -85.44 111.39 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.006 -175.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.421 ' HB3' ' HB3' ' A' ' 36' ' ' TRP . 34.5 mm-40 -94.17 140.63 29.52 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.3 1.44 . . . . 0.0 109.411 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -120.12 120.55 36.55 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.445 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 43.7 tp -68.82 86.86 0.34 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 172.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.513 HG21 HD11 ' A' ' 42' ' ' ILE . 88.4 t -73.18 106.08 2.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.187 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -74.54 100.54 3.91 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.7 m95 -73.24 145.03 46.48 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 3.8 ttmp? -71.24 -39.82 71.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 122.757 0.423 . . . . 0.0 111.836 -173.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.78 -10.97 74.94 Favored Glycine 0 C--N 1.346 1.112 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.403 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 23.3 m95 -110.24 141.67 24.37 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.496 0.718 . . . . 0.0 109.468 -176.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.73 163.65 36.72 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.414 2.076 . . . . 0.0 111.249 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.75 -26.28 72.58 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.045 2.497 . . . . 0.0 113.704 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.34 -38.71 88.27 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.253 0.621 . . . . 0.0 110.881 176.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.435 ' HB3' ' HE3' ' A' ' 29' ' ' TRP . 39.6 m-85 -99.05 0.45 43.75 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.463 0.705 . . . . 0.0 111.917 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.0 m -70.0 129.48 39.57 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 26.4 p -109.61 148.94 30.43 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.16 0.584 . . . . 0.0 111.833 -169.74 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 87.5 m95 -77.01 86.81 3.52 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.039 0.935 . . . . 0.0 110.402 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.459 ' HB2' HG21 ' A' ' 24' ' ' VAL . 38.8 mm-40 -97.9 118.44 63.89 Favored Pre-proline 0 C--O 1.241 0.647 0 C-N-CA 123.63 0.772 . . . . 0.0 109.305 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.42 ' O ' HG12 ' A' ' 42' ' ' ILE . 73.9 Cg_endo -73.65 177.46 7.99 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.176 1.917 . . . . 0.0 112.117 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.99 -27.2 51.79 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.745 1.218 . . . . 0.0 112.098 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.93 -28.72 69.73 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.918 1.287 . . . . 0.0 111.914 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 12.3 m170 -99.72 -28.76 13.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.045 0.938 . . . . 0.0 113.124 -172.803 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.513 HD11 HG21 ' A' ' 24' ' ' VAL . 43.8 mm -79.65 145.75 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 C-N-CA 123.948 0.899 . . . . 0.0 112.84 -169.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 mt -78.43 -64.34 1.19 Allowed 'General case' 0 C--N 1.358 0.974 0 C-N-CA 123.946 0.898 . . . . 0.0 110.852 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.93 117.46 65.12 Favored Pre-proline 0 N--CA 1.485 1.313 0 CA-C-O 119.412 -0.327 . . . . 0.0 110.628 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.99 -35.3 12.2 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.322 2.682 . . . . 0.0 112.6 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.0 mtm180 -70.45 -16.9 62.98 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.524 -174.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.5 tp -57.64 -44.03 85.33 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.537 1.135 . . . . 0.0 111.342 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.6 t -66.37 -41.94 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.543 0.737 . . . . 0.0 110.337 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.2 mtp -63.06 -30.49 71.64 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.397 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -37.01 85.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.678 0.791 . . . . 0.0 110.869 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.503 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.8 t80 -72.09 -35.04 69.11 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.973 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -64.03 -29.49 70.64 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.572 0.349 . . . . 0.0 110.589 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 . . . . . 0 N--CA 1.474 0.771 0 C-N-CA 123.34 0.656 . . . . 0.0 111.679 173.747 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 91.7 mttt . . . . . 0 C--O 1.238 0.469 0 CA-C-O 121.055 0.455 . . . . 0.0 111.839 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.53 127.9 54.34 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.161 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -110.78 162.19 15.03 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 169.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 . . . . . 0 C--O 1.24 0.556 0 C-N-CA 123.09 0.556 . . . . 0.0 110.025 -172.824 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 . . . . . 0 N--CA 1.476 0.841 0 CA-C-O 121.391 0.615 . . . . 0.0 111.789 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 69.1 t -128.31 129.36 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 125.378 1.471 . . . . 0.0 107.878 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 63.7 m-85 -141.7 162.59 35.11 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.367 0.667 . . . . 0.0 110.569 177.397 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.98 131.29 44.84 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.271 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.486 HG13 HD11 ' A' ' 47' ' ' LEU . 2.2 p -123.14 133.89 67.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 124.863 1.265 . . . . 0.0 108.55 -174.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -80.46 -40.39 26.32 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.706 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.3 p -175.91 179.46 1.33 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.788 0.835 . . . . 0.0 110.289 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.413 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.9 mm -89.73 122.78 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 165.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.531 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -80.89 -51.2 8.83 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.442 0.697 . . . . 0.0 109.371 -178.27 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.446 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 27.2 mtpp -137.11 171.77 14.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.621 0.768 . . . . 0.0 111.104 -175.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -155.24 143.25 20.04 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.538 0.735 . . . . 0.0 109.953 -174.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -160.91 144.43 13.25 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.701 0.8 . . . . 0.0 109.614 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.61 115.54 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -121.0 119.8 33.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.347 1.059 . . . . 0.0 109.41 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 63.51 25.65 14.52 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.175 0.99 . . . . 0.0 112.146 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.0 -12.78 52.43 Favored Glycine 0 N--CA 1.475 1.244 0 CA-C-N 116.227 -0.442 . . . . 0.0 113.053 -174.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.476 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 1.3 mmmp? -83.67 111.64 19.32 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.494 1.118 . . . . 0.0 108.546 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 t -82.09 106.23 12.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -97.3 142.9 28.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.459 1.104 . . . . 0.0 109.61 -174.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.413 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.6 m-85 -127.25 126.22 42.32 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.601 0.76 . . . . 0.0 109.693 -176.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.475 HD23 ' HB3' ' A' ' 11' ' ' ARG . 50.0 tp -67.7 94.17 0.42 Allowed 'General case' 0 C--N 1.349 0.583 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.523 HG21 HD11 ' A' ' 42' ' ' ILE . 90.1 t -77.1 104.01 4.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.879 -178.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 26.6 tptp -79.97 99.99 7.89 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -177.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.6 m95 -67.05 136.43 55.22 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -58.7 -33.75 70.53 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.037 0.535 . . . . 0.0 111.024 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.54 -55.43 2.71 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.495 176.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 98.4 m95 -77.97 129.57 75.55 Favored Pre-proline 0 CA--C 1.563 1.443 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -170.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.49 160.13 1.78 Allowed 'Trans proline' 0 C--N 1.387 2.603 0 C-N-CA 124.673 3.582 . . . . 0.0 113.465 172.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.463 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 32.1 Cg_endo -60.55 -17.8 50.67 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 123.132 2.554 . . . . 0.0 114.415 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.7 pttt -83.13 -32.65 26.56 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.639 0.376 . . . . 0.0 111.214 174.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -87.22 -8.67 56.59 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.108 0.563 . . . . 0.0 110.578 173.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 68.0 m -73.44 133.25 43.65 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 171.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.8 p -99.44 133.36 43.87 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.558 0.743 . . . . 0.0 111.075 -168.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -75.02 83.54 2.26 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.263 0.625 . . . . 0.0 110.106 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB2' HG21 ' A' ' 24' ' ' VAL . 44.4 mm-40 -104.85 130.59 22.91 Favored Pre-proline 0 N--CA 1.468 0.444 0 C-N-CA 123.262 0.625 . . . . 0.0 110.448 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.411 ' O ' HG12 ' A' ' 42' ' ' ILE . 40.0 Cg_endo -64.54 164.46 23.55 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 122.003 1.802 . . . . 0.0 112.037 170.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -52.86 -30.51 34.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.46 1.104 . . . . 0.0 111.701 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.9 -34.59 78.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.212 1.405 . . . . 0.0 111.468 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.0 m170 -85.1 -9.94 57.37 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.961 0.904 . . . . 0.0 112.793 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.523 HD11 HG21 ' A' ' 24' ' ' VAL . 38.8 mm -90.48 155.94 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 123.943 0.897 . . . . 0.0 110.959 -176.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -84.13 -77.67 0.26 Allowed 'General case' 0 C--N 1.353 0.748 0 C-N-CA 123.128 0.571 . . . . 0.0 109.98 167.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -75.14 127.92 85.72 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-O 119.673 -0.203 . . . . 0.0 111.168 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.26 -31.34 22.96 Favored 'Trans proline' 0 C--N 1.375 1.937 0 C-N-CA 122.547 2.164 . . . . 0.0 113.802 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.2 -14.42 37.74 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.486 HD11 HG13 ' A' ' 7' ' ' VAL . 3.5 mm? -60.3 -50.59 73.03 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 118.749 0.704 . . . . 0.0 110.012 170.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 74.1 t -67.51 -54.01 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.882 178.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.418 ' SD ' ' N ' ' A' ' 49' ' ' MET . 0.4 OUTLIER -58.97 -45.48 90.43 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.746 0.819 . . . . 0.0 112.09 -173.369 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.12 87.3 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.281 0.363 . . . . 0.0 111.175 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.45 -37.34 86.6 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.061 0.945 . . . . 0.0 110.747 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 31.0 mm-40 -69.95 -23.13 63.14 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.282 0.633 . . . . 0.0 111.081 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 . . . . . 0 N--CA 1.48 1.055 0 C-N-CA 124.27 1.028 . . . . 0.0 112.227 -179.684 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt . . . . . 0 C--O 1.242 0.66 0 CA-C-O 121.131 0.491 . . . . 0.0 110.756 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -112.77 134.06 54.48 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.714 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.463 ' HB2' HG11 ' A' ' 7' ' ' VAL . . . -109.19 -175.69 2.83 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 171.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 . . . . . 0 C--O 1.238 0.499 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -170.36 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 . . . . . 0 CA--C 1.541 0.597 0 N-CA-C 109.286 -0.635 . . . . 0.0 109.286 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -102.01 136.1 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.012 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -138.58 153.85 48.69 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.895 0.878 . . . . 0.0 109.014 170.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.66 134.38 47.49 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 173.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -120.63 141.78 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.211 1.005 . . . . 0.0 110.164 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -73.65 -60.27 2.33 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.579 174.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.3 p -170.91 -174.61 1.58 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.425 1.09 . . . . 0.0 109.548 -175.349 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.523 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 50.8 mm -97.87 117.86 43.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.24 -50.18 35.56 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.048 0.939 . . . . 0.0 110.529 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -140.72 170.8 15.09 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.475 0.71 . . . . 0.0 110.634 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -155.77 148.5 24.1 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.894 0.878 . . . . 0.0 108.635 -175.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.468 ' NH1' ' HD2' ' A' ' 16' ' ' ARG . 2.2 ptm180 -159.92 154.67 24.32 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.59 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -104.44 137.4 33.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 166.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.468 ' HD2' ' NH1' ' A' ' 14' ' ' ARG . 75.4 ttt180 -150.52 98.6 2.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -168.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 65.55 25.42 11.75 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.549 0.74 . . . . 0.0 111.115 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.71 -16.16 59.91 Favored Glycine 0 C--N 1.355 1.595 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.817 -173.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -84.24 111.32 19.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.9 t -86.95 108.04 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -97.05 144.43 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.126 0.57 . . . . 0.0 109.605 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.457 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.3 m-85 -123.45 116.82 23.86 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.7 tp -68.09 88.02 0.28 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 170.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.85 106.98 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.938 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -76.98 96.97 4.5 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.9 m95 -68.69 145.53 53.78 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -80.62 -30.35 36.75 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.6 -10.65 84.97 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 115.897 -0.592 . . . . 0.0 113.669 177.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.3 m95 -131.15 132.36 23.7 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 110.199 -177.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.42 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 32.4 Cg_endo -62.94 170.11 7.92 Favored 'Trans proline' 0 CA--C 1.572 2.395 0 C-N-CA 122.853 2.369 . . . . 0.0 112.483 175.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.62 -24.2 69.21 Favored 'Trans proline' 0 C--N 1.394 2.947 0 C-N-CA 122.793 2.328 . . . . 0.0 114.016 -174.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.86 -28.24 65.5 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.389 0.676 . . . . 0.0 112.512 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.55 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 80.2 m-85 -96.84 -3.59 41.83 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.17 0.588 . . . . 0.0 111.579 175.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.3 m -66.79 132.86 48.95 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.677 0.391 . . . . 0.0 109.988 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.1 p -122.79 150.37 42.9 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.651 -169.878 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -80.55 83.17 6.4 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.622 0.769 . . . . 0.0 110.521 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -95.17 121.22 62.75 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.57 165.39 29.45 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 121.853 1.702 . . . . 0.0 111.088 172.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -53.8 -27.25 28.12 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.078 0.951 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -60.3 -40.95 92.33 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.796 1.239 . . . . 0.0 110.992 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 17.3 m170 -81.45 -29.76 33.68 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.426 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.92 143.95 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.473 0.709 . . . . 0.0 111.348 -175.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.412 ' HB3' ' O ' ' B' ' 24' ' ' ALA . 5.1 tt -82.69 -77.53 0.23 Allowed 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.65 122.42 85.76 Favored Pre-proline 0 CA--C 1.556 1.186 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.33 -15.54 22.48 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 122.779 2.319 . . . . 0.0 114.107 -175.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 50.0 mtm180 -71.02 -12.14 61.36 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.25 -42.11 80.9 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 118.134 0.425 . . . . 0.0 111.127 170.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.508 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 48.0 t -62.12 -50.33 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.402 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 25.2 mmt -57.48 -40.16 77.97 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.129 0.972 . . . . 0.0 111.66 -177.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.17 -33.76 76.77 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.054 179.954 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.523 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 83.1 t80 -74.83 -37.67 62.23 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.429 0.692 . . . . 0.0 110.485 174.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 18.8 mm-40 -67.51 -20.49 65.45 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.792 0.437 . . . . 0.0 110.709 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 49' ' ' MET . 22.3 mm-40 . . . . . 0 N--CA 1.485 1.307 0 C-N-CA 123.699 0.799 . . . . 0.0 112.267 174.805 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? . . . . . 0 C--O 1.246 0.896 0 N-CA-C 108.685 -0.857 . . . . 0.0 108.685 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' A' ' 43' ' ' LEU . . . -121.28 125.46 47.11 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -94.6 -179.25 4.82 Favored 'General case' 0 C--O 1.244 0.794 0 N-CA-C 107.921 -1.141 . . . . 0.0 107.921 169.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 . . . . . 0 C--O 1.239 0.501 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -169.306 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 . . . . . 0 CA--C 1.541 0.605 0 CA-C-O 121.347 0.594 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.8 t -124.99 122.51 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -133.3 160.97 35.76 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 123.31 0.644 . . . . 0.0 109.967 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.02 136.3 55.06 Favored 'General case' 0 C--O 1.248 1.017 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 p -116.34 145.27 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.82 0.848 . . . . 0.0 110.178 -174.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 45.8 tt0 -78.87 -56.17 4.6 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.803 0.841 . . . . 0.0 109.748 176.852 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.0 p -175.19 -171.53 0.52 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.491 1.116 . . . . 0.0 110.2 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.547 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -99.68 117.97 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 170.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -52.17 14.08 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.509 1.124 . . . . 0.0 110.221 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -139.72 169.41 17.78 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.418 0.687 . . . . 0.0 111.353 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -155.77 137.67 14.44 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.313 1.045 . . . . 0.0 108.781 -177.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -160.94 137.63 8.7 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.98 0.912 . . . . 0.0 108.935 177.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.46 129.85 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -136.61 113.76 10.64 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? 62.21 33.41 16.77 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 124.547 1.139 . . . . 0.0 109.459 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.84 -18.94 18.2 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.749 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -84.54 111.01 19.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.51 0.724 . . . . 0.0 109.303 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.9 t -78.59 110.77 14.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -93.98 138.76 31.73 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.61 1.164 . . . . 0.0 109.894 -171.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.547 ' HB3' HD12 ' A' ' 10' ' ' ILE . 79.1 m-85 -125.54 116.42 21.74 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.432 0.693 . . . . 0.0 109.434 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.8 tp -69.54 91.52 0.59 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 170.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.624 HG21 HD11 ' A' ' 42' ' ' ILE . 73.1 t -73.43 106.18 3.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.174 -175.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.534 ' HE2' ' HD3' ' A' ' 31' ' ' PRO . 25.4 tptp -76.2 102.4 5.78 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 174.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -73.21 154.68 40.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.087 0.555 . . . . 0.0 110.894 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -75.75 -44.28 42.54 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 171.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.48 -41.42 30.12 Favored Glycine 0 C--N 1.352 1.462 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.194 -178.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -100.91 143.19 26.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.231 0.612 . . . . 0.0 111.166 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.37 172.86 14.11 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 123.5 2.8 . . . . 0.0 112.415 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . 0.534 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 30.0 Cg_endo -61.21 -29.23 86.25 Favored 'Trans proline' 0 C--N 1.394 2.921 0 C-N-CA 122.963 2.442 . . . . 0.0 113.401 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -67.5 -30.05 69.63 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.296 0.638 . . . . 0.0 111.401 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 13.88 29.27 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.629 0.771 . . . . 0.0 111.614 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.9 m -74.43 136.03 42.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 169.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.8 p -114.84 138.16 51.1 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.492 0.717 . . . . 0.0 112.046 -168.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -74.88 87.76 2.29 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.542 0.737 . . . . 0.0 109.899 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HB2' HD11 ' A' ' 42' ' ' ILE . 42.9 mm-40 -108.87 116.61 55.48 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 123.894 0.878 . . . . 0.0 109.905 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 37' ' ' GLU . 38.4 Cg_endo -63.25 169.15 9.83 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 122.551 2.167 . . . . 0.0 112.699 169.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -34.81 48.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.306 1.442 . . . . 0.0 113.244 -178.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -67.72 -34.37 76.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.893 0.877 . . . . 0.0 110.867 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -78.78 -17.8 55.19 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.625 0.77 . . . . 0.0 111.455 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.624 HD11 HG21 ' A' ' 24' ' ' VAL . 48.9 mm -98.5 148.78 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 124.359 1.064 . . . . 0.0 110.749 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.7 mt -82.1 -70.62 0.53 Allowed 'General case' 0 C--N 1.352 0.675 0 C-N-CA 123.49 0.716 . . . . 0.0 109.919 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -77.01 132.74 70.36 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.902 -171.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.435 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 98.1 Cg_endo -78.48 -30.44 3.2 Favored 'Trans proline' 0 CA--C 1.562 1.913 0 C-N-CA 122.52 2.147 . . . . 0.0 115.0 -176.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.435 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.32 0.0 OUTLIER -72.61 -9.7 58.91 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.031 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -53.18 -47.91 68.44 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 119.117 0.871 . . . . 0.0 109.911 166.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.422 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 63.0 t -60.87 -45.65 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.248 177.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.477 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 53.4 mtt -64.09 -30.1 71.19 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.649 0.78 . . . . 0.0 111.305 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.44 78.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 0.0 110.115 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 46.8 t80 -75.45 -35.12 60.96 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.743 174.389 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.7 mm-40 -69.76 -32.66 71.3 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.583 0.353 . . . . 0.0 111.063 -177.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 49' ' ' MET . 22.0 mm-40 . . . . . 0 N--CA 1.477 0.9 0 C-N-CA 123.344 0.658 . . . . 0.0 111.179 -178.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt . . . . . 0 C--O 1.251 1.166 0 N-CA-C 108.716 -0.846 . . . . 0.0 108.716 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -110.08 109.21 19.67 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.996 176.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.428 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.21 172.15 7.99 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 167.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 18.7 ttp180 . . . . . 0 CA--C 1.541 0.602 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.516 -165.282 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 . . . . . 0 N--CA 1.481 1.102 0 CA-C-O 120.988 0.423 . . . . 0.0 110.403 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.9 t -91.83 132.56 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 93.8 m-85 -131.93 163.0 29.31 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 171.865 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . 0.423 ' HB3' ' HE3' ' A' ' 27' ' ' LYS . . . -85.57 116.34 23.81 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.151 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.56 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -98.46 141.17 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.693 1.197 . . . . 0.0 109.28 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 9.7 tp10 -80.26 -49.53 11.47 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.0 p -171.38 171.79 5.41 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.142 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 49.5 mm -88.27 113.76 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.411 -0.813 . . . . 0.0 108.865 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.405 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.4 tmt_? -72.06 -53.07 13.98 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.546 0.738 . . . . 0.0 109.415 -178.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.455 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 65.6 mttm -137.82 173.89 11.16 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.316 0.646 . . . . 0.0 111.249 -176.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -157.5 150.38 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.974 0.91 . . . . 0.0 109.322 -174.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.9 ptt85 -168.23 178.75 4.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.622 1.169 . . . . 0.0 109.029 173.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.43 132.94 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.871 0.868 . . . . 0.0 108.747 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -142.64 111.76 6.52 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 59.91 42.61 16.02 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.575 1.15 . . . . 0.0 112.383 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.89 -17.32 32.24 Favored Glycine 0 N--CA 1.471 0.985 0 CA-C-N 115.8 -0.636 . . . . 0.0 113.516 176.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -84.73 109.91 18.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.1 t -83.92 104.13 11.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 171.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.458 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 1.0 OUTLIER -103.28 144.74 30.95 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.824 0.821 . . . . 0.0 110.9 -175.758 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -119.11 124.13 46.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.355 -173.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.455 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 55.1 tp -65.57 89.27 0.1 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 170.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.456 HG21 ' HB2' ' A' ' 37' ' ' GLU . 74.1 t -76.01 105.57 5.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.173 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -83.99 99.95 10.74 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 53.0 m95 -66.83 134.58 52.4 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -70.42 -15.96 62.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.479 0.312 . . . . 0.0 111.651 -177.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.09 10.11 22.74 Favored Glycine 0 C--N 1.351 1.373 0 CA-C-O 119.666 -0.519 . . . . 0.0 113.664 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 81.0 m95 -134.91 148.17 65.86 Favored Pre-proline 0 N--CA 1.498 1.965 0 CA-C-N 117.748 0.774 . . . . 0.0 110.158 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -74.53 165.27 32.05 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.911 2.407 . . . . 0.0 112.062 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.55 -33.87 49.87 Favored 'Trans proline' 0 C--N 1.391 2.775 0 C-N-CA 124.084 3.189 . . . . 0.0 114.646 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -69.43 -30.21 68.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.061 0.544 . . . . 0.0 112.357 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -95.05 -8.41 36.77 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.609 0.764 . . . . 0.0 111.441 175.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 59.4 m -75.35 112.23 11.44 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 20.4 p -98.36 147.79 24.33 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.64 0.776 . . . . 0.0 111.795 -169.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -75.12 89.02 2.46 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.441 0.696 . . . . 0.0 110.226 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.456 ' HB2' HG21 ' A' ' 24' ' ' VAL . 45.8 mm-40 -97.89 119.5 62.16 Favored Pre-proline 0 N--CA 1.469 0.507 0 C-N-CA 123.461 0.704 . . . . 0.0 109.872 178.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 47.4 Cg_endo -66.31 167.49 18.38 Favored 'Trans proline' 0 C--N 1.369 1.636 0 C-N-CA 122.07 1.846 . . . . 0.0 112.001 172.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.07 -27.0 61.33 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.416 1.087 . . . . 0.0 112.262 176.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.42 -35.33 65.28 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 125.176 1.39 . . . . 0.0 111.717 171.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 16.6 m170 -93.44 -18.15 22.66 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.075 0.95 . . . . 0.0 112.559 -173.92 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.1 mm -86.54 151.57 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.061 0.944 . . . . 0.0 111.352 -171.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -96.73 -69.15 0.77 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.749 0.82 . . . . 0.0 110.823 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.15 117.34 53.38 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.42 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 72.0 Cg_endo -74.37 -17.83 20.93 Favored 'Trans proline' 0 C--N 1.369 1.646 0 C-N-CA 122.722 2.281 . . . . 0.0 113.185 -175.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.42 ' HD3' ' HG2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -72.22 -12.22 61.07 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.502 0.721 . . . . 0.0 112.481 -177.652 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.405 HD11 HG13 ' A' ' 7' ' ' VAL . 2.2 mm? -52.13 -51.06 60.22 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 118.512 0.597 . . . . 0.0 110.59 169.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 59.3 t -61.04 -48.4 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 124.107 0.879 . . . . 0.0 109.694 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.2 mmt -60.44 -38.49 84.31 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.998 -175.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.84 -36.41 83.39 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.754 0.821 . . . . 0.0 110.571 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.545 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 81.5 t80 -69.8 -42.72 73.36 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.723 0.809 . . . . 0.0 110.424 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.3 mm-40 -60.69 -37.88 83.14 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.263 0.625 . . . . 0.0 111.285 -177.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 . . . . . 0 N--CA 1.476 0.834 0 C-N-CA 123.884 0.873 . . . . 0.0 112.218 -179.482 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 71.8 mttt . . . . . 0 N--CA 1.473 0.705 0 N-CA-C 109.492 -0.558 . . . . 0.0 109.492 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -107.06 106.64 17.25 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.097 0.475 . . . . 0.0 110.761 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -106.75 151.05 25.66 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 162.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 . . . . . 0 C--N 1.316 -0.875 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -175.098 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 15.0 mm100 . . . . . 0 CA--C 1.542 0.648 0 CA-C-O 120.63 0.253 . . . . 0.0 110.846 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 91.4 t -103.24 116.19 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.565 0.746 . . . . 0.0 109.108 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -130.34 167.03 19.18 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 123.718 0.807 . . . . 0.0 109.402 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.13 122.06 19.44 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.2 p -97.97 135.94 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.356 0.662 . . . . 0.0 110.177 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -68.19 -52.72 31.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.951 0.901 . . . . 0.0 110.007 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.2 p -177.72 178.0 1.05 Allowed 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.714 -176.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.464 HD12 ' HB3' ' A' ' 22' ' ' TYR . 47.9 mm -89.95 114.99 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 168.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.558 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -69.82 -51.4 33.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.643 0.777 . . . . 0.0 109.05 -179.393 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -139.26 161.82 36.49 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.301 0.641 . . . . 0.0 111.348 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . 0.528 ' HE3' HG11 ' A' ' 20' ' ' VAL . 83.1 tttt -147.69 133.35 18.85 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 108.064 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -159.29 139.39 11.97 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 123.476 0.71 . . . . 0.0 109.396 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.469 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 5.0 p -87.22 121.41 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -134.46 123.49 24.07 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.74 0.816 . . . . 0.0 109.045 -176.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 64.24 28.02 13.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.324 1.05 . . . . 0.0 111.854 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.83 -16.97 53.31 Favored Glycine 0 C--N 1.351 1.406 0 CA-C-N 115.484 -0.78 . . . . 0.0 113.258 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -105.46 134.3 48.8 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.82 0.848 . . . . 0.0 110.443 -176.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.528 HG11 ' HE3' ' A' ' 13' ' ' LYS . 21.7 t -83.2 116.36 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -174.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -95.36 142.03 28.23 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 124.895 1.278 . . . . 0.0 109.741 -178.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.464 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.1 m-85 -125.0 120.44 31.56 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.49 0.716 . . . . 0.0 109.75 -178.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.512 HD23 ' HD2' ' A' ' 11' ' ' ARG . 27.7 tp -75.22 82.32 2.37 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 169.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.469 HG21 HD11 ' A' ' 42' ' ' ILE . 67.1 t -68.65 106.49 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.421 -175.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.3 tptp -84.53 102.82 13.15 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.597 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.8 m95 -71.5 147.05 48.14 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.247 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -78.44 -36.14 45.87 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.157 0.583 . . . . 0.0 109.903 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.43 -14.45 82.16 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.775 178.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.597 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.4 m95 -120.3 148.92 48.51 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 123.253 0.621 . . . . 0.0 111.381 -175.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 169.97 20.62 Favored 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.22 2.613 . . . . 0.0 112.2 175.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -55.52 -26.43 54.45 Favored 'Trans proline' 0 C--N 1.393 2.893 0 C-N-CA 123.715 2.943 . . . . 0.0 114.999 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -70.41 -9.23 55.8 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.423 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 69.5 m-85 -118.02 14.25 14.06 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.869 0.867 . . . . 0.0 111.409 175.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -70.07 116.8 10.86 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.0 p -105.36 137.19 43.56 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.297 0.639 . . . . 0.0 111.878 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -73.87 83.43 1.68 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.111 0.564 . . . . 0.0 109.933 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -110.62 113.14 55.96 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 123.892 0.877 . . . . 0.0 108.863 176.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.429 ' HA ' ' HD2' ' A' ' 22' ' ' TYR . 61.9 Cg_endo -66.8 166.84 21.1 Favored 'Trans proline' 0 C--N 1.365 1.424 0 C-N-CA 122.238 1.959 . . . . 0.0 111.782 173.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.21 -23.87 50.75 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.582 1.153 . . . . 0.0 112.807 -177.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -62.46 -27.25 68.99 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.106 1.362 . . . . 0.0 111.655 178.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 11.4 m-70 -113.01 2.84 15.9 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.398 1.079 . . . . 0.0 112.408 -173.243 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.568 HD12 ' HB1' ' B' ' 25' ' ' ALA . 48.8 mm -101.16 148.55 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 124.58 1.152 . . . . 0.0 110.793 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.629 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 53.5 mt -75.68 -78.93 0.1 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 122.989 0.515 . . . . 0.0 110.811 172.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -75.05 112.85 19.92 Favored Pre-proline 0 N--CA 1.48 1.07 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -174.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -78.21 -13.65 15.29 Favored 'Trans proline' 0 C--N 1.371 1.752 0 C-N-CA 122.872 2.382 . . . . 0.0 112.945 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.56 -12.38 61.34 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.469 0.708 . . . . 0.0 111.41 179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.591 HD22 ' NZ ' ' B' ' 23' ' ' LYS . 3.1 mm? -51.05 -39.16 55.31 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.478 0.311 . . . . 0.0 110.87 167.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.5 -51.48 46.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 123.861 0.864 . . . . 0.0 110.882 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 28.3 ptm -64.08 -35.08 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.0 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.11 -34.03 76.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.672 0.789 . . . . 0.0 111.315 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.443 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 74.3 t80 -70.14 -35.36 74.01 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.458 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -85.14 -7.44 59.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.5 0.72 . . . . 0.0 111.965 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 49' ' ' MET . 43.8 mm-40 . . . . . 0 N--CA 1.473 0.677 0 C-N-CA 122.71 0.404 . . . . 0.0 109.978 166.67 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . 0.591 ' NZ ' HD22 ' A' ' 47' ' ' LEU . 6.8 mtpm? . . . . . 0 C--O 1.241 0.635 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 . . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -117.96 137.93 52.51 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.107 0.479 . . . . 0.0 111.041 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.568 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -102.9 -167.65 1.42 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.41 171.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . 0.629 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 75.9 ttt180 . . . . . 0 N--CA 1.473 0.716 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -172.582 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 . . . . . 0 N--CA 1.475 0.779 0 N-CA-C 110.778 -0.082 . . . . 0.0 110.778 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.403 HG22 ' HD3' ' B' ' 26' ' ' ARG . 20.0 t -88.3 127.19 41.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.464 0.706 . . . . 0.0 109.635 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.427 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 87.7 m-85 -140.58 152.76 45.74 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.291 0.636 . . . . 0.0 110.113 172.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.28 117.37 11.75 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 170.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -91.39 134.19 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 110.104 -177.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.533 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 43.8 tt0 -68.04 -43.68 78.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.424 0.69 . . . . 0.0 110.505 178.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 p 177.94 169.51 0.72 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.386 1.074 . . . . 0.0 110.399 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -82.19 113.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.267 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.496 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -73.02 -58.12 3.54 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -177.378 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.422 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 98.3 mttt -134.31 174.29 10.68 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.723 0.809 . . . . 0.0 109.789 -178.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -159.85 141.59 12.95 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 123.756 0.822 . . . . 0.0 109.075 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -154.12 159.46 41.48 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.521 0.728 . . . . 0.0 109.755 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 20' ' ' VAL . 40.8 t -104.13 130.25 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 168.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -146.73 111.53 5.31 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.3 tptt 65.43 26.35 11.91 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.809 1.243 . . . . 0.0 110.324 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.83 -9.21 46.0 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-N 115.228 -0.896 . . . . 0.0 113.156 -174.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.06 110.55 20.71 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 15' ' ' VAL . 47.9 t -84.1 107.07 15.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -174.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -98.49 141.42 31.37 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.784 0.834 . . . . 0.0 110.477 -173.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.48 ' HB3' HG23 ' A' ' 10' ' ' ILE . 8.6 m-85 -114.23 125.01 53.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.422 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 31.9 tp -70.86 85.17 0.67 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 169.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.408 HG21 ' HB2' ' A' ' 37' ' ' GLU . 95.3 t -72.78 104.13 1.92 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.454 -173.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.8 tptp -84.0 100.34 11.0 Favored 'General case' 0 C--N 1.345 0.388 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.547 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.1 m95 -69.35 151.03 46.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.623 -179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.533 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 35.7 ttpt -67.88 -46.11 72.6 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 122.981 0.512 . . . . 0.0 111.419 -173.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.87 -6.15 72.81 Favored Glycine 0 C--N 1.35 1.34 0 CA-C-N 115.878 -0.601 . . . . 0.0 113.868 -176.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.547 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 56.3 m95 -114.85 129.49 24.97 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.404 0.682 . . . . 0.0 110.148 -175.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -61.57 165.35 13.64 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.155 2.57 . . . . 0.0 112.35 171.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -64.41 -8.95 18.38 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.378 2.718 . . . . 0.0 114.709 -175.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -26.84 61.0 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.464 0.306 . . . . 0.0 110.998 173.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -99.45 -12.41 20.24 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.813 0.845 . . . . 0.0 111.52 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.7 p -64.65 119.8 11.21 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.7 p -107.06 150.27 26.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.787 0.835 . . . . 0.0 111.113 -172.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -76.41 86.63 3.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.46 0.704 . . . . 0.0 110.194 178.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.408 ' HB2' HG21 ' A' ' 24' ' ' VAL . 47.2 mm-40 -98.17 110.19 55.1 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 123.607 0.763 . . . . 0.0 109.356 175.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.479 ' O ' HG12 ' A' ' 42' ' ' ILE . 61.7 Cg_endo -68.99 176.43 6.2 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.257 1.972 . . . . 0.0 112.114 172.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -60.08 -23.22 63.61 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.501 0.72 . . . . 0.0 112.354 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -58.45 -38.85 78.35 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 124.223 1.009 . . . . 0.0 110.975 172.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 42.6 m170 -94.18 -15.7 24.36 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.346 1.058 . . . . 0.0 112.457 -173.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 38' ' ' PRO . 46.6 mm -83.69 147.15 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 123.567 0.747 . . . . 0.0 112.121 -173.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -88.2 -70.47 0.63 Allowed 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.827 0.851 . . . . 0.0 109.896 172.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -77.42 115.97 53.88 Favored Pre-proline 0 CA--C 1.55 0.956 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 -176.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.3 -18.95 20.18 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.713 2.275 . . . . 0.0 112.955 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.455 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 75.2 mtm180 -73.99 -15.04 61.11 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.718 0.807 . . . . 0.0 111.974 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.9 mt -53.43 -52.55 59.04 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.029 0.932 . . . . 0.0 112.13 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.66 -34.97 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.238 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.455 ' SD ' ' HA ' ' A' ' 46' ' ' ARG . 57.5 mtt -59.97 -43.27 95.2 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.49 0.716 . . . . 0.0 111.017 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.62 78.48 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.389 0.676 . . . . 0.0 111.412 176.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -73.93 -32.94 63.75 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -75.38 -20.49 58.94 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.585 0.754 . . . . 0.0 112.118 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 . . . . . 0 N--CA 1.476 0.858 0 C-N-CA 123.081 0.552 . . . . 0.0 111.267 173.216 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt . . . . . 0 C--O 1.243 0.715 0 N-CA-C 109.886 -0.412 . . . . 0.0 109.886 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -96.03 137.96 34.35 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.063 0.545 . . . . 0.0 110.557 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.99 167.52 12.08 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 169.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . 0.403 ' HD3' HG22 ' A' ' 4' ' ' VAL . 60.1 ttp180 . . . . . 0 N--CA 1.469 0.499 0 CA-C-O 121.355 0.598 . . . . 0.0 109.565 -178.714 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 . . . . . 0 CA--C 1.543 0.695 0 N-CA-C 109.868 -0.419 . . . . 0.0 109.868 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.38 134.24 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.342 1.057 . . . . 0.0 109.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 61.8 m-85 -132.52 159.02 40.62 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 123.227 0.611 . . . . 0.0 109.633 172.365 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.03 124.97 24.54 Favored 'General case' 0 C--O 1.249 1.064 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 170.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.468 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 6.3 p -113.59 145.86 18.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 C-N-CA 124.019 0.927 . . . . 0.0 110.349 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -78.67 -61.59 1.96 Allowed 'General case' 0 C--O 1.245 0.828 0 C-N-CA 124.042 0.937 . . . . 0.0 109.935 179.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.7 p -167.47 -172.09 1.85 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.041 0.936 . . . . 0.0 110.024 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.433 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.4 mm -102.2 133.6 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.476 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -85.62 -58.67 2.57 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.359 1.063 . . . . 0.0 109.19 -177.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.498 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 68.6 mttm -132.54 179.68 5.99 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.788 0.835 . . . . 0.0 110.264 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -156.24 154.63 31.03 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -169.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -164.41 170.54 15.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.421 1.088 . . . . 0.0 109.454 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.72 112.94 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 171.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -129.9 112.7 13.8 Favored 'General case' 0 C--O 1.24 0.585 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -174.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 80.6 tttt 63.77 33.92 12.45 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.021 1.328 . . . . 0.0 110.199 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.32 -14.85 43.16 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.236 -0.893 . . . . 0.0 113.744 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -84.2 112.38 20.21 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.412 0.685 . . . . 0.0 109.643 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.12 106.52 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -103.77 137.16 42.18 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.959 0.904 . . . . 0.0 110.755 -170.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.433 ' HB3' HD12 ' A' ' 10' ' ' ILE . 87.3 m-85 -119.0 126.83 52.64 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 124.326 1.05 . . . . 0.0 109.224 -171.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.498 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 33.4 tp -74.47 84.67 2.01 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.453 HG21 HD11 ' A' ' 42' ' ' ILE . 68.4 t -64.71 108.24 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 124.625 1.17 . . . . 0.0 111.174 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.6 tptp -94.64 102.23 14.12 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.241 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.568 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 21.1 m95 -74.72 152.58 39.09 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.663 0.785 . . . . 0.0 110.162 -178.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -80.7 -29.24 36.48 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 122.218 0.207 . . . . 0.0 111.262 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.36 -3.87 62.89 Favored Glycine 0 C--N 1.346 1.115 0 O-C-N 123.479 0.487 . . . . 0.0 113.023 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.568 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 62.0 m95 -124.23 127.86 25.2 Favored Pre-proline 0 CA--C 1.553 1.072 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -60.44 163.78 14.42 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 123.066 2.511 . . . . 0.0 112.234 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -61.93 -10.15 16.61 Favored 'Trans proline' 0 C--N 1.386 2.545 0 C-N-CA 123.007 2.471 . . . . 0.0 114.843 -174.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.84 -31.29 71.81 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.815 0.279 . . . . 0.0 110.902 172.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 60.6 m-85 -98.51 10.82 40.06 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 112.122 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.2 p -68.69 125.06 25.38 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.5 p -112.95 129.97 56.29 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.631 0.772 . . . . 0.0 111.588 -169.313 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -68.94 82.26 0.31 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.651 0.78 . . . . 0.0 110.708 175.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.414 ' HB2' HD11 ' A' ' 42' ' ' ILE . 21.5 mm-40 -107.9 115.68 58.39 Favored Pre-proline 0 C--O 1.243 0.749 0 C-N-CA 123.774 0.829 . . . . 0.0 109.149 177.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.461 ' O ' HG12 ' A' ' 42' ' ' ILE . 41.9 Cg_endo -63.68 168.91 10.84 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.481 2.121 . . . . 0.0 112.048 170.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.5 -19.34 63.49 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.17 -37.79 78.2 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.864 0.865 . . . . 0.0 111.129 169.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -87.37 -18.18 30.65 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 112.342 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.528 HD12 ' HB1' ' B' ' 25' ' ' ALA . 42.0 mm -93.74 146.15 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 124.277 0.986 . . . . 0.0 111.657 -172.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.499 HD11 ' HE ' ' B' ' 26' ' ' ARG . 95.6 mt -87.91 -65.51 1.01 Allowed 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.577 0.751 . . . . 0.0 110.87 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -72.12 124.27 90.62 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 122.921 0.489 . . . . 0.0 110.143 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.57 -17.88 20.36 Favored 'Trans proline' 0 C--N 1.374 1.879 0 C-N-CA 122.734 2.289 . . . . 0.0 112.995 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.543 ' HA ' ' HB3' ' A' ' 49' ' ' MET . 54.4 mtm180 -73.66 -11.44 60.41 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.784 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.77 -53.7 48.62 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.217 0.917 . . . . 0.0 110.925 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.7 p -69.3 -44.0 80.78 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.156 176.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.543 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 23.2 ttt -57.05 -41.95 79.63 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.395 0.678 . . . . 0.0 111.92 -177.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.14 73.86 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.936 0.894 . . . . 0.0 110.436 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 67.7 t80 -75.17 -28.14 59.96 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.67 176.436 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 23.8 mm-40 -81.82 -6.86 59.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.773 0.429 . . . . 0.0 111.822 177.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 . . . . . 0 N--CA 1.483 1.206 0 C-N-CA 122.898 0.479 . . . . 0.0 111.513 175.861 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mttp . . . . . 0 N--CA 1.474 0.736 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -138.75 111.26 7.55 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.378 0.671 . . . . 0.0 109.502 176.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.528 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -99.37 167.53 10.58 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.868 174.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . 0.499 ' HE ' HD11 ' A' ' 43' ' ' LEU . 15.2 ttm180 . . . . . 0 C--O 1.24 0.584 0 C-N-CA 123.255 0.622 . . . . 0.0 109.531 -176.704 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 . . . . . 0 N--CA 1.475 0.811 0 CA-C-O 121.471 0.653 . . . . 0.0 111.27 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.7 t -117.42 131.99 68.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.797 1.639 . . . . 0.0 107.871 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . 0.421 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 69.1 m-85 -132.66 164.45 26.69 Favored 'General case' 0 C--O 1.248 0.98 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 173.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 104.93 1.54 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 168.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.519 HG13 HD11 ' A' ' 47' ' ' LEU . 2.9 p -89.57 138.57 19.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.711 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.08 -178.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.598 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 38.2 tt0 -71.81 -62.56 1.37 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.231 1.012 . . . . 0.0 109.561 176.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.404 ' HA ' HD12 ' A' ' 47' ' ' LEU . 27.7 p -173.6 -172.57 0.78 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.512 1.125 . . . . 0.0 109.216 -177.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.447 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.4 mm -94.78 133.16 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 169.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -99.2 -37.06 9.45 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.186 0.594 . . . . 0.0 110.558 -174.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.441 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 65.9 mttm -143.69 169.96 16.76 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.992 0.917 . . . . 0.0 109.921 176.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -152.48 149.29 28.39 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -174.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -163.71 -175.47 4.15 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.414 1.085 . . . . 0.0 109.487 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -144.02 141.63 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 173.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -137.9 107.89 6.35 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.616 0.767 . . . . 0.0 109.045 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.4 mttt 61.75 36.5 16.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.869 0.868 . . . . 0.0 111.482 173.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.62 -13.82 66.46 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.57 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -88.12 107.45 18.77 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.9 t -83.53 108.49 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -96.52 138.75 33.64 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.465 0.706 . . . . 0.0 110.197 -169.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.447 ' HB3' HD12 ' A' ' 10' ' ' ILE . 71.1 m-85 -122.66 121.94 37.61 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.898 0.879 . . . . 0.0 108.633 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.441 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 26.1 tp -71.68 86.64 0.93 Allowed 'General case' 0 C--O 1.24 0.583 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 174.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 78.4 t -70.85 104.82 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.494 -176.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -81.37 100.24 9.13 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.421 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 21.7 m95 -76.14 124.43 27.41 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 172.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.598 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -72.37 113.93 9.94 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.658 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 118.07 -14.65 12.4 Favored Glycine 0 C--N 1.346 1.139 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.215 -172.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -110.07 135.19 20.54 Favored Pre-proline 0 N--CA 1.475 0.799 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.29 155.24 30.68 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.746 2.297 . . . . 0.0 112.869 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.43 -13.44 10.29 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 123.52 2.813 . . . . 0.0 114.298 176.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -82.75 -46.47 13.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.693 0.397 . . . . 0.0 110.196 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -79.68 -1.36 37.99 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.252 0.621 . . . . 0.0 112.206 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.6 p -64.68 132.14 48.87 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 165.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 38.1 p -109.75 138.21 46.44 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.039 0.536 . . . . 0.0 111.98 -166.428 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -74.29 87.31 1.98 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.41 0.684 . . . . 0.0 110.107 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -103.74 125.1 35.63 Favored Pre-proline 0 N--CA 1.468 0.473 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.43 ' O ' HG12 ' A' ' 42' ' ' ILE . 56.3 Cg_endo -67.55 166.37 24.14 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 121.845 1.697 . . . . 0.0 112.447 172.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -52.24 -31.08 30.64 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 125.457 1.503 . . . . 0.0 112.337 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -60.45 -35.75 76.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.518 1.527 . . . . 0.0 110.99 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -91.65 -14.34 30.29 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.2 1.0 . . . . 0.0 112.989 -175.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 38' ' ' PRO . 41.2 mm -88.41 153.07 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.076 0.55 . . . . 0.0 110.914 -175.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' B' ' 24' ' ' ALA . 89.1 mt -90.85 -67.22 0.86 Allowed 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 171.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -82.97 134.61 46.27 Favored Pre-proline 0 CA--C 1.565 1.555 0 C-N-CA 123.001 0.521 . . . . 0.0 110.588 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . 0.43 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 88.9 Cg_endo -79.83 -32.04 1.66 Allowed 'Trans proline' 0 CA--C 1.571 2.342 0 C-N-CA 122.72 2.28 . . . . 0.0 116.072 -177.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.43 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.26 0.0 OUTLIER -71.42 -11.38 60.85 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -166.739 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.519 HD11 HG13 ' A' ' 7' ' ' VAL . 2.9 mm? -53.54 -46.63 70.25 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.807 0.731 . . . . 0.0 110.203 171.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 98.1 t -70.26 -42.38 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.758 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -68.98 -42.43 76.55 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.406 -175.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.21 -30.91 71.85 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.951 0.9 . . . . 0.0 111.868 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.02 -52.27 25.49 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.015 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -81.76 -17.7 46.78 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -172.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 . . . . . 0 N--CA 1.486 1.326 0 CA-C-N 117.992 0.36 . . . . 0.0 111.742 -176.268 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . 0.483 ' HE3' ' HA ' ' B' ' 23' ' ' LYS . 0.0 OUTLIER . . . . . 0 N--CA 1.469 0.503 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' A' ' 43' ' ' LEU . . . -117.79 112.34 20.27 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -103.08 168.61 9.07 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 166.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 75.3 ttt180 . . . . . 0 N--CA 1.471 0.58 0 CA-C-O 120.789 0.328 . . . . 0.0 110.139 -172.488 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 . . . . . 0 C--O 1.248 1.026 0 CA-C-O 121.338 0.59 . . . . 0.0 110.887 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 39.1 t -105.33 140.31 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 114.255 -1.339 . . . . 0.0 109.371 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -132.1 152.27 51.31 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.776 0.83 . . . . 0.0 109.166 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.03 128.27 35.09 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.46 132.47 70.62 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.439 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -69.29 -61.7 1.68 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.996 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.8 p -167.59 -169.34 1.18 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.758 -172.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.527 HD12 ' HB3' ' A' ' 22' ' ' TYR . 51.2 mm -105.5 139.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.432 ' HB3' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -92.64 -48.5 6.56 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.676 0.791 . . . . 0.0 109.97 -179.875 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -137.53 161.47 36.31 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.395 0.678 . . . . 0.0 111.156 -176.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -146.22 142.91 28.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.819 0.848 . . . . 0.0 109.179 -177.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -165.13 143.99 6.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.788 0.835 . . . . 0.0 109.137 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 7.2 p -92.09 125.29 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -133.15 104.52 6.54 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.992 0.517 . . . . 0.0 109.611 -169.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 62.52 30.64 17.16 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.008 0.923 . . . . 0.0 110.656 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 -17.46 51.07 Favored Glycine 0 C--N 1.348 1.237 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.569 -174.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -94.87 109.99 21.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.632 0.773 . . . . 0.0 109.272 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.7 t -79.24 111.44 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -90.53 143.75 26.45 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 123.696 0.798 . . . . 0.0 109.786 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.527 ' HB3' HD12 ' A' ' 10' ' ' ILE . 98.6 m-85 -125.94 123.51 38.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.432 HD23 ' HB3' ' A' ' 11' ' ' ARG . 43.1 tp -71.47 84.23 0.82 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 169.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.662 HG21 HD11 ' A' ' 42' ' ' ILE . 99.8 t -69.09 104.37 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.086 -172.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -78.06 99.76 6.24 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.899 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.535 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.8 m95 -69.07 139.54 54.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.958 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.18 -31.63 70.37 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 120.718 0.294 . . . . 0.0 110.559 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.74 -26.16 47.07 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.929 -0.578 . . . . 0.0 113.616 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 94.4 m95 -110.87 138.48 21.13 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 122.968 0.507 . . . . 0.0 111.363 -172.3 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -52.95 157.65 7.72 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.526 2.817 . . . . 0.0 113.248 173.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -57.82 -20.24 42.77 Favored 'Trans proline' 0 C--N 1.383 2.362 0 C-N-CA 123.327 2.685 . . . . 0.0 113.925 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -80.77 -31.39 35.87 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.377 0.671 . . . . 0.0 111.434 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -88.9 -4.37 58.48 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.383 0.673 . . . . 0.0 111.174 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.8 m -68.19 137.45 54.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.216 0.607 . . . . 0.0 109.606 172.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.9 p -111.88 143.2 43.23 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.051 0.541 . . . . 0.0 111.826 -170.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -75.57 85.66 2.64 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.669 0.788 . . . . 0.0 110.145 177.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.507 ' HB2' HD11 ' A' ' 42' ' ' ILE . 28.1 mm-40 -102.98 128.06 28.53 Favored Pre-proline 0 C--O 1.238 0.465 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.15 162.28 40.85 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.753 1.636 . . . . 0.0 110.9 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.98 -16.48 43.45 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.984 0.514 . . . . 0.0 112.01 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -55.67 -50.84 69.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.803 1.241 . . . . 0.0 109.996 170.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -76.96 -16.67 59.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.732 -174.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.662 HD11 HG21 ' A' ' 24' ' ' VAL . 46.0 mm -91.43 147.03 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.207 1.003 . . . . 0.0 111.161 -172.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 62.6 mt -87.34 -71.12 0.58 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 122.966 0.506 . . . . 0.0 109.641 172.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . 0.432 ' O ' HD23 ' A' ' 47' ' ' LEU . 14.3 t70 -68.92 112.58 11.94 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 122.919 0.488 . . . . 0.0 110.024 -176.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -81.65 -9.15 12.32 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.479 2.12 . . . . 0.0 113.187 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ttp180 -70.98 -16.54 62.64 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.787 0.835 . . . . 0.0 110.081 -178.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 44' ' ' ASP . 4.5 mm? -49.88 -47.39 52.01 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.759 0.824 . . . . 0.0 111.513 169.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.9 t -67.97 -50.43 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.823 0.849 . . . . 0.0 110.615 -178.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.411 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 25.8 mmt -58.5 -53.27 60.19 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.072 -177.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.89 78.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.574 1.15 . . . . 0.0 112.164 -177.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -62.63 -55.11 30.1 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.548 177.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -74.82 -6.18 47.62 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -170.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' MET . 60.7 mt-10 . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 121.02 0.438 . . . . 0.0 110.687 171.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . 0.419 ' HE2' HD22 ' A' ' 47' ' ' LEU . 7.3 mtpm? . . . . . 0 C--O 1.244 0.796 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -136.77 130.09 31.43 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.557 0.694 . . . . 0.0 110.28 -178.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.63 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -109.73 166.34 10.99 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.729 178.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 . . . . . 0 C--O 1.239 0.533 0 C-N-CA 123.343 0.657 . . . . 0.0 109.326 -172.106 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 26.9 mp0 . . . . . 0 N--CA 1.471 0.594 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.556 HG22 ' HB3' ' B' ' 26' ' ' ARG . 48.4 t -85.74 103.94 13.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 123.721 0.808 . . . . 0.0 109.092 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -129.38 174.13 9.9 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.458 0.703 . . . . 0.0 110.703 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.76 114.26 20.28 Favored 'General case' 0 C--O 1.245 0.864 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.013 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.613 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.7 p -107.72 149.49 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.658 1.183 . . . . 0.0 109.93 -178.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 8.1 tp10 -86.02 -59.0 2.42 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.925 0.393 . . . . 0.0 109.992 174.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . 0.487 ' HA ' HD12 ' A' ' 47' ' ' LEU . 15.9 p -169.6 179.89 3.61 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.77 -171.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.592 HD12 ' HB3' ' A' ' 22' ' ' TYR . 40.9 mm -86.64 128.61 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 172.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.503 ' HD2' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -76.28 -49.3 17.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.887 0.875 . . . . 0.0 109.472 176.518 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.8 tttp -148.72 164.71 33.56 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.61 0.364 . . . . 0.0 110.054 -172.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -142.24 154.01 44.42 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.151 0.58 . . . . 0.0 109.462 -171.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . 0.568 ' HG3' ' HB2' ' A' ' 21' ' ' GLU . 10.0 ptm180 -171.45 -174.24 1.38 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.247 1.419 . . . . 0.0 108.831 179.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -143.71 142.51 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -137.33 104.65 5.44 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.584 0.754 . . . . 0.0 109.069 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm 59.72 34.35 22.03 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.786 1.234 . . . . 0.0 111.302 177.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.79 -14.57 65.01 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 115.241 -0.89 . . . . 0.0 114.292 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -85.2 109.87 18.62 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.6 t -78.22 111.05 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -175.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.568 ' HB2' ' HG3' ' A' ' 14' ' ' ARG . 5.3 mm-40 -95.86 140.27 30.87 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.865 0.866 . . . . 0.0 110.575 -168.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.592 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.6 m-85 -129.99 121.52 26.69 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.871 0.868 . . . . 0.0 109.146 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.503 HD23 ' HD2' ' A' ' 11' ' ' ARG . 24.0 tp -73.68 80.06 1.53 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.3 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.568 HG21 HD11 ' A' ' 42' ' ' ILE . 40.8 t -65.17 106.18 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.525 1.13 . . . . 0.0 109.708 -175.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.447 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 13.7 tptm -90.3 104.61 17.17 Favored 'General case' 0 C--O 1.243 0.749 0 C-N-CA 123.239 0.615 . . . . 0.0 110.019 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.613 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 36.9 m95 -77.56 127.07 31.89 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.238 1.015 . . . . 0.0 108.937 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.562 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -64.5 -28.8 69.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -166.466 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.17 -2.81 54.46 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 116.749 -0.205 . . . . 0.0 113.209 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.595 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 76.9 m95 -111.44 150.09 41.6 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 123.642 0.777 . . . . 0.0 110.727 -173.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -64.73 158.54 50.02 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.861 2.374 . . . . 0.0 111.836 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -62.81 -18.53 64.98 Favored 'Trans proline' 0 C--N 1.378 2.103 0 C-N-CA 123.067 2.511 . . . . 0.0 113.686 -179.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -71.55 -30.01 65.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.573 0.349 . . . . 0.0 110.511 173.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 12.6 m-85 -86.36 -5.03 59.26 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.712 0.805 . . . . 0.0 111.862 176.982 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 t -68.92 123.88 22.19 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 170.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.7 p -115.87 136.74 52.75 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.119 0.967 . . . . 0.0 112.12 -165.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -76.5 84.92 3.21 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 172.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.517 ' HB2' HD11 ' A' ' 42' ' ' ILE . 49.1 mm-40 -101.05 140.4 21.27 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 123.358 0.663 . . . . 0.0 109.222 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -78.48 158.97 29.07 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 121.794 1.663 . . . . 0.0 111.602 174.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -54.9 -25.01 26.27 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 123.907 0.883 . . . . 0.0 112.083 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -59.3 -31.46 69.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.685 1.194 . . . . 0.0 112.077 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 14.8 m-70 -127.83 25.0 6.02 Favored 'General case' 0 C--O 1.25 1.083 0 C-N-CA 123.753 0.821 . . . . 0.0 112.538 -170.198 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.568 HD11 HG21 ' A' ' 24' ' ' VAL . 37.5 mm -103.9 150.8 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 125.041 1.336 . . . . 0.0 110.293 168.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.492 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 4.9 tt -81.23 -82.57 0.12 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.225 1.01 . . . . 0.0 108.826 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -78.5 132.51 65.35 Favored Pre-proline 0 CA--C 1.559 1.31 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -80.45 -16.82 10.46 Favored 'Trans proline' 0 C--N 1.377 2.028 0 C-N-CA 122.57 2.18 . . . . 0.0 113.711 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . 0.438 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 65.1 mtm180 -71.98 -11.12 60.62 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.866 0.866 . . . . 0.0 113.203 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.497 HD11 HG13 ' A' ' 7' ' ' VAL . 3.1 mm? -58.7 -44.49 90.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 118.774 0.715 . . . . 0.0 109.812 167.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.37 -44.21 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.386 1.074 . . . . 0.0 110.52 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.438 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 96.0 mmm -65.25 -51.64 59.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.196 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.68 70.49 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.955 0.902 . . . . 0.0 111.547 179.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -65.92 -49.17 68.91 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.001 0.521 . . . . 0.0 110.304 175.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.17 -5.71 59.29 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.679 0.792 . . . . 0.0 112.28 -177.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 . . . . . 0 N--CA 1.481 1.083 0 C-N-CA 123.592 0.757 . . . . 0.0 110.191 168.434 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm . . . . . 0 N--CA 1.483 1.192 0 CA-C-O 121.112 0.482 . . . . 0.0 110.427 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.2 134.31 47.65 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 171.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.54 -175.6 2.98 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 171.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . 0.556 ' HB3' HG22 ' A' ' 4' ' ' VAL . 4.5 ptp180 . . . . . 0 N--CA 1.467 0.396 0 C-N-CA 123.4 0.68 . . . . 0.0 109.591 -178.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 . . . . . 0 N--CA 1.476 0.853 0 CA-C-O 120.689 0.281 . . . . 0.0 111.538 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.9 t -100.66 140.12 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 124.189 0.995 . . . . 0.0 110.549 -177.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -142.28 163.28 33.29 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.062 0.945 . . . . 0.0 110.195 171.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.84 153.55 36.75 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.013 174.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.462 HG11 ' HB2' ' B' ' 25' ' ' ALA . 7.3 p -155.31 153.56 7.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.645 0 C-N-CA 124.311 1.045 . . . . 0.0 108.415 -176.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -121.9 -36.77 2.95 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.722 175.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -133.75 138.86 46.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.561 -166.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.8 mm -91.08 111.82 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 161.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.98 -54.19 14.38 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.708 0.63 . . . . 0.0 109.997 -173.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.421 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 99.2 mttt -139.2 176.84 8.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.823 0.849 . . . . 0.0 110.568 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -157.91 143.16 16.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.215 1.006 . . . . 0.0 108.933 -173.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -155.51 166.02 34.8 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.085 0.954 . . . . 0.0 108.582 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.4 t -127.86 114.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . 0.422 ' HD3' ' OE1' ' A' ' 21' ' ' GLU . 74.5 mtp180 -125.34 115.95 21.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 123.983 0.913 . . . . 0.0 108.92 -178.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt 64.21 24.76 13.47 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 125.458 1.503 . . . . 0.0 111.55 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.04 -16.04 60.5 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.755 -177.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.831 -0.804 . . . . 0.0 108.831 178.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 t -82.65 109.09 16.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.422 ' OE1' ' HD3' ' A' ' 16' ' ' ARG . 50.9 mt-10 -94.81 141.47 28.59 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.801 0.84 . . . . 0.0 110.279 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -120.18 120.49 36.31 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.784 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.421 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 33.9 tp -71.58 86.97 0.9 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.6 t -73.17 107.98 4.19 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.976 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.452 ' O ' HG23 ' A' ' 7' ' ' VAL . 20.5 tptm -78.69 99.89 6.81 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 175.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 68.0 m95 -69.94 129.67 40.12 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 175.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -20.59 62.2 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.006 0.366 . . . . 0.0 111.329 -176.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -99.05 7.46 60.47 Favored Glycine 0 C--N 1.354 1.57 0 C-N-CA 123.338 0.494 . . . . 0.0 113.626 178.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -133.7 141.1 38.78 Favored Pre-proline 0 N--CA 1.486 1.374 0 C-N-CA 123.639 0.776 . . . . 0.0 109.529 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -62.84 159.32 38.28 Favored 'Trans proline' 0 CA--C 1.565 2.031 0 C-N-CA 122.214 1.943 . . . . 0.0 110.717 168.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.22 0.56 4.41 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.083 2.522 . . . . 0.0 114.221 -174.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.09 -14.56 59.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.237 0.615 . . . . 0.0 111.562 170.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -119.27 7.25 11.24 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.663 0.785 . . . . 0.0 111.052 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.4 p -69.27 122.58 19.16 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 28.9 p -101.44 143.71 31.13 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.329 0.652 . . . . 0.0 111.314 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -76.82 86.35 3.41 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -94.5 113.08 60.1 Favored Pre-proline 0 N--CA 1.472 0.632 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 174.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 36.7 Cg_endo -64.71 172.48 6.86 Favored 'Trans proline' 0 C--N 1.371 1.728 0 C-N-CA 121.787 1.658 . . . . 0.0 113.616 175.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . 0.517 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 11.4 pt-20 -43.75 -41.86 5.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 126.696 1.998 . . . . 0.0 114.156 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . 0.517 ' HG3' ' HG3' ' A' ' 39' ' ' GLU . 24.2 mt-10 -75.09 -29.57 60.68 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.694 1.198 . . . . 0.0 111.015 -176.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.2 m80 -86.46 -2.96 58.9 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.405 1.082 . . . . 0.0 112.858 -172.171 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.87 149.73 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 124.889 1.276 . . . . 0.0 110.471 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.555 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 30.5 mt -81.98 -77.62 0.22 Allowed 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 167.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -68.31 110.53 5.89 Favored Pre-proline 0 C--N 1.362 1.12 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -170.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.68 -22.7 23.75 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.425 2.083 . . . . 0.0 112.076 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -70.81 -14.83 62.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.597 0.759 . . . . 0.0 111.443 -177.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.6 mt -57.29 -46.51 83.08 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.713 0.805 . . . . 0.0 111.227 170.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -63.05 -53.18 49.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.754 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.463 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 1.3 mpt? -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.23 0.956 . . . . 0.0 111.141 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.4 99.43 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.956 0.902 . . . . 0.0 110.74 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -63.84 -42.24 97.64 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.175 0.99 . . . . 0.0 110.391 174.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 59.0 mt-10 -76.12 -10.44 59.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.758 0.823 . . . . 0.0 112.953 -174.487 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 49' ' ' MET . 52.0 mt-10 . . . . . 0 N--CA 1.489 1.523 0 C-N-CA 122.473 0.309 . . . . 0.0 110.967 172.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp . . . . . 0 N--CA 1.491 1.577 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -109.63 116.23 31.35 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.925 0.49 . . . . 0.0 110.42 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.462 ' HB2' HG11 ' A' ' 7' ' ' VAL . . . -94.54 -173.33 3.0 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 167.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . 0.555 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 15.3 ttt180 . . . . . 0 C--N 1.323 -0.581 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.26 -176.127 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 . . . . . 0 CA--C 1.544 0.749 0 CA-C-O 120.7 0.286 . . . . 0.0 111.603 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.79 139.73 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.504 1.122 . . . . 0.0 108.611 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -137.79 167.61 21.37 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.777 . . . . 0.0 109.989 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.06 124.5 25.09 Favored 'General case' 0 C--O 1.248 0.974 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.519 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.445 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -110.25 145.29 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.655 0.782 . . . . 0.0 110.534 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -90.0 -46.12 8.72 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.27 1.028 . . . . 0.0 110.763 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.4 p -175.46 -170.12 0.4 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.487 0.715 . . . . 0.0 110.663 -172.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.452 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.3 mm -111.79 120.98 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 168.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.423 ' HB3' HD23 ' A' ' 23' ' ' LEU . 0.4 OUTLIER -74.31 -56.25 5.09 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.077 0.951 . . . . 0.0 109.677 -179.313 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.468 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 33.6 mtmm -137.61 176.52 8.63 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.962 0.905 . . . . 0.0 111.066 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -156.99 152.53 26.73 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.756 1.222 . . . . 0.0 108.448 -173.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -165.7 164.15 19.0 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.452 0.701 . . . . 0.0 109.723 177.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.481 HG22 HG22 ' A' ' 20' ' ' VAL . 38.6 t -108.87 126.92 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 166.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -139.0 105.77 5.38 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.413 1.085 . . . . 0.0 108.94 -170.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 62.26 26.86 16.11 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.375 1.07 . . . . 0.0 111.623 -176.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.08 -15.46 62.83 Favored Glycine 0 C--N 1.348 1.205 0 CA-C-N 115.733 -0.667 . . . . 0.0 113.175 -176.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.257 0.623 . . . . 0.0 110.009 178.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.481 HG22 HG22 ' A' ' 15' ' ' VAL . 43.7 t -76.21 104.47 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 175.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -98.62 149.29 22.93 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.527 0.731 . . . . 0.0 110.679 -176.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.452 ' HB3' HD12 ' A' ' 10' ' ' ILE . 92.8 m-85 -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.175 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . 0.468 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 36.4 tp -70.12 86.71 0.56 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.425 HG21 HD11 ' A' ' 42' ' ' ILE . 75.7 t -70.63 107.35 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.106 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -79.79 102.07 8.85 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.544 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.0 m95 -77.28 154.27 33.1 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.648 -177.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -76.74 -33.25 58.13 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.419 0.687 . . . . 0.0 109.662 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.26 -25.51 28.42 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.529 -0.759 . . . . 0.0 113.414 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.544 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 97.6 m95 -106.54 135.22 19.53 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-N 117.338 0.569 . . . . 0.0 111.424 -176.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -53.98 158.76 8.38 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.461 2.774 . . . . 0.0 113.098 170.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -63.68 -16.81 56.96 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 123.225 2.617 . . . . 0.0 113.621 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -79.95 -36.72 35.77 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.884 0.474 . . . . 0.0 110.858 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -83.6 -5.76 59.26 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.322 0.649 . . . . 0.0 111.37 177.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.8 m -66.58 134.73 52.95 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 169.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.7 p -120.4 159.27 25.44 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.295 0.638 . . . . 0.0 111.824 -169.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.02 84.51 6.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.928 0.891 . . . . 0.0 110.464 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -101.34 111.79 64.16 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.44 177.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -61.57 165.51 13.33 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 122.135 1.89 . . . . 0.0 112.326 172.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -60.16 -21.45 61.67 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.216 1.007 . . . . 0.0 112.734 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.38 -33.04 71.89 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.249 1.02 . . . . 0.0 111.017 173.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.0 m80 -83.26 -29.88 28.07 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.538 -175.632 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.481 HD12 ' HB1' ' B' ' 25' ' ' ALA . 40.1 mm -88.83 144.87 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.936 0.895 . . . . 0.0 111.949 -165.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.0 mt -85.31 -72.79 0.47 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.426 0.69 . . . . 0.0 111.061 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.09 131.99 77.66 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -78.53 -18.63 12.05 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.666 2.244 . . . . 0.0 114.027 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -71.71 -13.19 61.65 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -172.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . 0.434 HD11 HG13 ' A' ' 7' ' ' VAL . 2.6 mm? -61.6 -47.38 85.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 168.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . 0.482 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 91.5 t -64.21 -46.54 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.649 176.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.2 mmt -57.82 -39.71 78.25 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.674 0.789 . . . . 0.0 111.566 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.25 85.24 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.201 1.0 . . . . 0.0 110.885 177.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . 0.416 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 68.1 t80 -73.14 -35.98 66.6 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.716 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 35.9 mm-40 -69.86 -13.1 62.1 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.193 0.597 . . . . 0.0 112.271 -175.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 . . . . . 0 N--CA 1.481 1.078 0 C-N-CA 123.583 0.753 . . . . 0.0 112.784 179.085 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt . . . . . 0 C--O 1.25 1.109 0 CA-C-O 121.292 0.568 . . . . 0.0 111.598 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.82 108.02 18.67 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.804 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.481 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.06 155.42 16.81 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 163.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 7.5 ttt180 . . . . . 0 C--N 1.321 -0.666 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -169.6 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 1.7 mp0 . . . . . 0 CA--C 1.548 0.887 0 CA-C-O 121.076 0.465 . . . . 0.0 111.084 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.5 t -112.47 124.84 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.389 1.076 . . . . 0.0 108.345 172.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -135.23 162.29 32.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.7 0.8 . . . . 0.0 109.623 178.078 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.91 107.06 5.09 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.448 0.699 . . . . 0.0 109.197 175.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . 0.523 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.1 p -85.43 135.0 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.09 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . 0.512 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.8 tp10 -69.11 -50.4 48.44 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.157 0.583 . . . . 0.0 109.758 175.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 p 178.76 -175.89 0.22 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.526 1.53 . . . . 0.0 108.853 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . 0.516 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -85.62 122.77 38.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.604 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.5 tmt_? -67.82 -56.05 10.63 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.337 1.055 . . . . 0.0 109.194 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.427 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.8 mttt -140.81 157.92 44.7 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.116 -176.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -139.32 143.67 37.95 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.269 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -169.04 138.1 2.1 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.902 0.751 . . . . 0.0 109.924 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -86.16 124.28 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -127.07 105.2 8.42 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.483 1.113 . . . . 0.0 109.156 -173.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 59.51 32.95 22.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.57 1.148 . . . . 0.0 111.087 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.92 2.65 83.85 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.588 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -107.14 111.63 24.14 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.444 0.698 . . . . 0.0 109.827 174.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 t -74.18 110.52 8.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -93.7 144.04 25.76 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.156 0.982 . . . . 0.0 109.386 -173.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . 0.516 ' HB3' HD12 ' A' ' 10' ' ' ILE . 94.6 m-85 -128.86 109.36 11.2 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.617 0.767 . . . . 0.0 109.097 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.8 tp -67.36 97.11 0.54 Allowed 'General case' 0 C--N 1.345 0.388 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.1 t -76.47 105.93 5.86 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 C-N-CA 123.768 0.827 . . . . 0.0 110.131 -173.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.604 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.1 tptp -82.24 100.12 9.7 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.657 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 46.2 m95 -69.04 140.64 54.94 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.8 ttpt -59.98 -50.84 72.16 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 123.585 0.553 . . . . 0.0 111.874 -172.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.85 -28.41 31.81 Favored Glycine 0 C--N 1.341 0.819 0 CA-C-N 115.921 -0.581 . . . . 0.0 113.343 -177.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.657 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 58.1 m95 -89.26 123.83 66.12 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.713 0.405 . . . . 0.0 110.147 -175.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . 0.481 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 72.4 Cg_exo -53.76 164.92 2.05 Favored 'Trans proline' 0 C--N 1.38 2.205 0 C-N-CA 123.645 2.897 . . . . 0.0 113.979 174.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.75 -23.56 33.96 Favored 'Trans proline' 0 C--N 1.387 2.584 0 C-N-CA 123.674 2.916 . . . . 0.0 114.855 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . 0.481 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.4 pttt -66.3 -33.0 74.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.227 0.611 . . . . 0.0 112.124 176.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.468 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 75.0 m-85 -91.35 -13.39 32.6 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.274 0.63 . . . . 0.0 111.544 176.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.8 m -66.92 130.77 44.23 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.0 p -119.47 145.04 46.64 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.477 0.711 . . . . 0.0 111.164 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -76.2 79.51 3.0 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.575 0.75 . . . . 0.0 110.252 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -93.18 113.67 60.64 Favored Pre-proline 0 C--O 1.236 0.373 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 175.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.59 178.5 4.41 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.595 1.53 . . . . 0.0 113.271 -178.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -38.18 -42.71 0.7 Allowed 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 127.186 2.194 . . . . 0.0 115.214 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.91 -20.67 52.44 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.517 0.727 . . . . 0.0 111.995 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -112.73 16.78 19.5 Favored 'General case' 0 C--O 1.253 1.276 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -164.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 32.3 mm -101.69 152.64 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 125.474 1.51 . . . . 0.0 109.213 172.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.41 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 91.1 mt -83.45 -73.89 0.39 Allowed 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.08 0.4 . . . . 0.0 110.817 176.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.79 118.3 70.02 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.0 -19.92 26.07 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.557 2.171 . . . . 0.0 112.724 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -10.08 59.25 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.326 178.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -49.14 -42.04 38.25 Favored 'General case' 0 N--CA 1.507 2.392 0 CA-C-N 119.248 0.931 . . . . 0.0 110.412 167.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -51.57 57.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.918 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mmt -55.27 -42.36 73.46 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.856 0.862 . . . . 0.0 111.49 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -66.65 -39.43 88.22 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.871 1.268 . . . . 0.0 111.339 -175.892 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.68 -46.76 35.76 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.47 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 62.5 mt-10 -68.71 -6.3 25.46 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.449 0.7 . . . . 0.0 112.793 -170.957 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 . . . . . 0 CA--C 1.556 1.181 0 C-N-CA 123.524 0.73 . . . . 0.0 112.006 168.78 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 22.8 mtpp . . . . . 0 N--CA 1.48 1.046 0 CA-C-O 120.914 0.387 . . . . 0.0 110.081 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.18 125.77 53.8 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.31 0.644 . . . . 0.0 110.117 174.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.59 175.51 9.1 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 124.189 0.996 . . . . 0.0 108.508 171.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . 0.41 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 45.0 ttp180 . . . . . 0 C--O 1.235 0.315 0 C-N-CA 123.065 0.546 . . . . 0.0 110.706 -173.455 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 . . . . . 0 N--CA 1.481 1.097 0 N-CA-C 113.196 0.814 . . . . 0.0 113.196 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.3 t -116.67 140.8 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.963 1.305 . . . . 0.0 108.584 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -141.31 158.63 43.63 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.53 0.732 . . . . 0.0 110.373 171.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.75 114.87 11.36 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.588 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -87.27 138.76 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.345 1.058 . . . . 0.0 110.249 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -76.28 -57.4 3.89 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 122.922 0.489 . . . . 0.0 109.821 175.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.0 m -157.16 170.95 21.33 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.013 0.925 . . . . 0.0 110.16 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.2 mm -89.28 110.9 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 162.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.516 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.6 tmt_? -66.37 -58.46 5.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.348 1.059 . . . . 0.0 109.198 -177.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' LYS . . . . . 0.492 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.5 mtpp -137.58 170.88 15.31 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.774 0.83 . . . . 0.0 111.444 -177.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -156.68 129.4 7.7 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.432 1.093 . . . . 0.0 108.898 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -157.84 150.72 22.94 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.682 0.793 . . . . 0.0 109.235 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 20' ' ' VAL . 47.2 t -93.43 112.68 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 173.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -107.2 96.83 6.7 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.761 1.224 . . . . 0.0 108.751 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.3 tptt 62.11 49.28 4.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.645 1.178 . . . . 0.0 110.938 176.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 81.82 -18.28 12.94 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.677 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -86.68 110.54 19.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.005 0.922 . . . . 0.0 109.57 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 15' ' ' VAL . 21.4 t -78.71 103.75 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -98.41 144.95 27.22 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.235 1.014 . . . . 0.0 110.554 -173.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -126.32 119.92 28.59 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.089 0.956 . . . . 0.0 108.602 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.3 tp -70.72 90.81 0.79 Allowed 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 169.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.531 HG21 HD11 ' A' ' 42' ' ' ILE . 63.7 t -78.02 105.26 6.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 123.697 0.799 . . . . 0.0 109.95 -173.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.4 tptp -77.41 103.55 7.4 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.45 0.7 . . . . 0.0 109.14 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' TRP . . . . . 0.498 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -77.04 157.32 31.2 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 110.111 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -64.55 -41.98 95.98 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.931 0.492 . . . . 0.0 111.098 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.0 -24.39 35.08 Favored Glycine 0 C--N 1.346 1.098 0 CA-C-N 115.935 -0.575 . . . . 0.0 113.597 -177.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' TRP . . . . . 0.498 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 77.0 m95 -104.45 124.59 36.67 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 122.906 0.482 . . . . 0.0 111.055 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -52.98 163.66 1.99 Allowed 'Trans proline' 0 C--N 1.386 2.524 0 C-N-CA 124.056 3.17 . . . . 0.0 113.363 171.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -62.84 -26.64 74.77 Favored 'Trans proline' 0 C--N 1.385 2.497 0 C-N-CA 123.08 2.52 . . . . 0.0 113.448 -174.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -78.47 -26.25 46.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.069 0.548 . . . . 0.0 111.278 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' TYR . . . . . 0.402 ' HB3' ' HE3' ' A' ' 29' ' ' TRP . 87.3 m-85 -92.75 2.11 56.92 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.838 0.855 . . . . 0.0 111.391 175.041 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.0 m -76.3 155.73 34.0 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.369 0.667 . . . . 0.0 110.347 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.3 p -115.35 135.43 54.14 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.258 0.623 . . . . 0.0 112.481 -171.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -74.95 82.49 2.2 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.91 0.884 . . . . 0.0 110.286 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -106.06 123.07 40.26 Favored Pre-proline 0 N--CA 1.465 0.299 0 C-N-CA 123.751 0.82 . . . . 0.0 109.432 178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' PRO . . . . . 0.535 ' O ' HG12 ' A' ' 42' ' ' ILE . 38.3 Cg_endo -64.19 165.05 20.6 Favored 'Trans proline' 0 C--N 1.368 1.6 0 C-N-CA 122.361 2.04 . . . . 0.0 112.15 173.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -56.43 -27.92 57.97 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.192 0.997 . . . . 0.0 111.021 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -55.5 -45.26 77.06 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.604 1.561 . . . . 0.0 111.226 169.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 42.5 m170 -88.13 -7.29 57.15 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.066 0.946 . . . . 0.0 113.169 -176.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' ILE . . . . . 0.65 HD12 ' HB1' ' B' ' 25' ' ' ALA . 41.8 mm -94.26 139.22 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.814 0.846 . . . . 0.0 109.833 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' LEU . . . . . 0.579 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 94.9 mt -71.48 -64.76 0.86 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.833 0.453 . . . . 0.0 110.078 175.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.69 109.99 22.04 Favored Pre-proline 0 CA--C 1.556 1.184 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.161 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.8 -9.89 19.78 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.782 2.321 . . . . 0.0 112.704 -176.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 -72.89 -12.63 61.04 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.311 0.644 . . . . 0.0 111.341 -176.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.89 -43.38 86.07 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.914 0.486 . . . . 0.0 110.975 169.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.6 t -64.81 -42.05 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.693 0.797 . . . . 0.0 109.938 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' MET . . . . . 0.401 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 24.7 mmt -60.36 -47.49 85.81 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.276 177.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.9 80.4 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.507 1.123 . . . . 0.0 111.565 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.7 t80 -68.08 -34.08 75.75 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.89 0.876 . . . . 0.0 110.774 176.005 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -90.79 -9.06 47.95 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.932 0.493 . . . . 0.0 111.881 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 49' ' ' MET . 30.0 mm-40 . . . . . 0 N--CA 1.484 1.263 0 C-N-CA 122.933 0.493 . . . . 0.0 110.02 171.456 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.248 0.991 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 . . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -113.76 112.02 22.73 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.423 0.63 . . . . 0.0 110.63 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 25' ' ' ALA . . . . . 0.65 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -85.87 168.94 13.77 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.464 165.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' B' B ' 26' ' ' ARG . . . . . 0.579 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 23.1 ttt180 . . . . . 0 N--CA 1.471 0.611 0 CA-C-O 121.488 0.661 . . . . 0.0 111.289 -175.096 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.803 0 N-CA-C 110.889 -0.884 . . . . 0.0 110.889 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.5 OUTLIER -145.58 176.31 9.71 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.95 0.9 . . . . 0.0 110.659 -171.641 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.635 ' HB2' ' HB3' ' B' ' 27' ' ' M3L . 1.3 mp0 -82.08 81.73 7.92 Favored 'General case' 0 CA--C 1.543 0.7 0 C-N-CA 123.624 0.77 . . . . 0.0 109.593 -174.695 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 71.3 t -82.51 120.8 34.64 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.494 0 C-N-CA 123.472 0.709 . . . . 0.0 109.622 176.713 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.425 ' HE2' ' HB3' ' A' ' 3' ' ' GLN . 86.8 m-85 -137.14 161.91 34.85 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.736 0.814 . . . . 0.0 109.676 178.367 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.89 129.87 37.64 Favored 'General case' 0 C--O 1.245 0.838 0 N-CA-C 108.759 -0.83 . . . . 0.0 108.759 174.654 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.419 HG13 HD11 ' A' ' 47' ' ' LEU . 2.7 p -111.25 143.11 21.75 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.513 0 C-N-CA 124.507 1.123 . . . . 0.0 110.418 -172.478 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -76.0 -58.99 2.96 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 124.468 1.107 . . . . 0.0 109.378 176.63 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 49.9 p -174.14 -172.28 0.69 Allowed 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 124.402 1.081 . . . . 0.0 109.775 -176.141 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.444 HD12 ' HB3' ' A' ' 22' ' ' TYR . 48.2 mm -98.01 120.07 46.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 N-CA-C 107.946 -1.131 . . . . 0.0 107.946 171.558 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.491 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -73.68 -53.93 9.26 Favored 'General case' 0 CA--C 1.554 1.118 0 C-N-CA 124.127 0.971 . . . . 0.0 109.552 179.812 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.476 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 99.0 mttt -138.05 174.45 10.55 Favored 'General case' 0 N--CA 1.495 1.796 0 C-N-CA 123.916 0.886 . . . . 0.0 111.342 -176.508 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.2 tttt -154.55 144.79 21.99 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.35 1.06 . . . . 0.0 108.724 -178.648 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.4 ptm180 -161.45 -179.2 7.16 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.984 0.914 . . . . 0.0 109.538 -179.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 41.2 t -135.14 118.76 24.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.781 0 N-CA-C 108.229 -1.026 . . . . 0.0 108.229 175.916 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 46.9 ttp180 -136.83 129.85 30.95 Favored 'General case' 0 N--CA 1.477 0.908 0 C-N-CA 124.333 1.053 . . . . 0.0 109.274 178.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 17.0 mmtm 62.68 24.92 14.84 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.994 0.918 . . . . 0.0 111.63 -177.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 82.04 -8.44 60.42 Favored Glycine 0 C--N 1.352 1.424 0 CA-C-N 115.816 -0.629 . . . . 0.0 113.232 -175.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 28.9 mmmt -85.87 117.99 25.07 Favored 'General case' 0 C--O 1.239 0.524 0 C-N-CA 123.84 0.856 . . . . 0.0 108.935 -178.84 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 49.7 t -79.09 104.8 7.45 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 175.89 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 63.1 mt-10 -97.68 139.08 34.11 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.946 0.898 . . . . 0.0 110.139 -170.596 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.444 ' HB3' HD12 ' A' ' 10' ' ' ILE . 15.1 m-85 -118.13 121.3 40.18 Favored 'General case' 0 N--CA 1.468 0.453 0 N-CA-C 108.665 -0.865 . . . . 0.0 108.665 178.826 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.452 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 28.0 tp -74.8 94.64 2.79 Favored 'General case' 0 CA--C 1.533 0.292 0 N-CA-C 108.242 -1.021 . . . . 0.0 108.242 172.51 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 29.8 t -76.69 105.98 6.13 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 C-N-CA 123.622 0.769 . . . . 0.0 109.97 -174.828 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.491 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.0 tptp -81.65 106.92 13.98 Favored 'General case' 0 N--CA 1.468 0.437 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.053 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.621 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 77.4 m95 -77.16 149.97 35.56 Favored 'General case' 0 CA--C 1.534 0.361 0 C-N-CA 123.571 0.748 . . . . 0.0 110.787 -177.85 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.0 ttpt -77.44 -34.06 54.63 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.076 0.55 . . . . 0.0 111.322 -174.131 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -106.51 15.31 42.13 Favored Glycine 0 C--N 1.343 0.944 0 CA-C-N 116.229 -0.442 . . . . 0.0 113.008 -178.684 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.621 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 88.8 m95 -133.48 136.83 27.69 Favored Pre-proline 0 C--O 1.246 0.887 0 C-N-CA 123.125 0.57 . . . . 0.0 110.067 177.882 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.443 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 88.4 Cg_exo -52.21 158.05 5.72 Favored 'Trans proline' 0 C--N 1.378 2.08 0 C-N-CA 123.355 2.704 . . . . 0.0 113.333 167.965 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 60.7 Cg_endo -69.42 5.54 1.53 Allowed 'Trans proline' 0 C--N 1.377 2.049 0 C-N-CA 123.406 2.737 . . . . 0.0 114.603 179.644 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.443 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.0 pttt -90.03 -15.88 30.91 Favored 'General case' 0 N--CA 1.485 1.293 0 C-N-CA 122.779 0.431 . . . . 0.0 110.923 170.106 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 97.7 m-85 -96.32 -2.6 45.47 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 123.54 0.736 . . . . 0.0 111.441 174.298 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 78.4 p -63.53 122.52 16.49 Favored 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 123.069 0.547 . . . . 0.0 110.727 178.848 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 13.8 p -102.43 135.91 43.21 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.74 0.816 . . . . 0.0 111.366 -172.057 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.2 m95 -76.33 75.37 3.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.276 0.63 . . . . 0.0 109.494 174.223 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 66.4 mm-40 -90.65 117.95 68.33 Favored Pre-proline 0 CA--C 1.535 0.386 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 179.521 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 48.8 Cg_endo -67.19 169.16 15.78 Favored 'Trans proline' 0 C--N 1.37 1.695 0 C-N-CA 121.996 1.797 . . . . 0.0 111.756 173.776 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -50.11 -39.41 42.78 Favored 'General case' 0 N--CA 1.483 1.22 0 C-N-CA 124.985 1.314 . . . . 0.0 114.378 -171.579 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 23.6 mm-40 -83.78 -1.47 54.33 Favored 'General case' 0 N--CA 1.482 1.151 0 N-CA-C 113.249 0.833 . . . . 0.0 113.249 -175.787 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.401 ' O ' ' HG3' ' B' ' 26' ' ' ARG . 27.3 m-70 -115.72 14.19 16.35 Favored 'General case' 0 N--CA 1.487 1.422 0 C-N-CA 123.881 0.873 . . . . 0.0 111.236 178.61 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 28.9 mm -103.42 150.24 6.99 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.458 0 C-N-CA 126.11 1.764 . . . . 0.0 109.541 175.002 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.435 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 5.6 tt -89.44 -79.47 0.33 Allowed 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 108.824 -0.806 . . . . 0.0 108.824 -179.748 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.41 ' O ' HD23 ' A' ' 47' ' ' LEU . 13.3 t70 -80.66 126.63 77.71 Favored Pre-proline 0 CA--C 1.555 1.172 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 -179.164 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.2 Cg_endo -80.45 -13.7 12.07 Favored 'Trans proline' 0 C--N 1.375 1.965 0 C-N-CA 122.755 2.304 . . . . 0.0 114.247 -175.553 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -70.55 -15.11 62.74 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 123.387 0.675 . . . . 0.0 112.74 -178.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.419 HD11 HG13 ' A' ' 7' ' ' VAL . 3.9 mm? -58.42 -53.27 60.19 Favored 'General case' 0 N--CA 1.491 1.625 0 CA-C-N 118.335 0.516 . . . . 0.0 111.715 178.573 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 7.4 p -74.14 -32.53 32.7 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.701 0 CA-C-N 115.392 -0.822 . . . . 0.0 110.876 -175.964 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.497 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 26.0 mmt -62.4 -52.34 63.97 Favored 'General case' 0 N--CA 1.478 0.962 0 N-CA-C 110.033 -0.358 . . . . 0.0 110.033 175.452 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -56.78 -38.25 72.24 Favored 'General case' 0 N--CA 1.486 1.326 0 C-N-CA 124.494 1.118 . . . . 0.0 111.58 178.582 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 41.4 t80 -62.82 -47.37 83.71 Favored 'General case' 0 CA--C 1.549 0.937 0 C-N-CA 124.206 1.003 . . . . 0.0 110.928 175.929 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.4 mt-10 -82.34 -9.9 59.29 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 113.046 0.758 . . . . 0.0 113.046 -173.069 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.497 ' HG2' ' O ' ' A' ' 49' ' ' MET . 27.3 mm-40 -63.6 -31.02 72.06 Favored 'General case' 0 N--CA 1.482 1.153 0 CA-C-O 120.942 0.401 . . . . 0.0 110.447 169.938 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 12.3 mptt -95.45 -23.17 17.25 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.168 0.987 . . . . 0.0 110.708 -179.88 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.4 tp10 -65.73 140.47 58.45 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.728 0.811 . . . . 0.0 111.061 -178.264 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 C--O 1.252 1.199 0 C-N-CA 123.799 0.84 . . . . 0.0 109.245 178.703 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 4.6 pm0 . . . . . 0 N--CA 1.48 1.064 0 N-CA-C 109.888 -0.412 . . . . 0.0 109.888 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 97.1 mt -85.26 85.42 7.46 Favored 'General case' 0 N--CA 1.471 0.613 0 N-CA-C 109.34 -0.615 . . . . 0.0 109.34 178.882 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -87.06 126.33 34.69 Favored 'General case' 0 N--CA 1.469 0.496 0 CA-C-N 115.281 -0.872 . . . . 0.0 109.132 177.599 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.0 t -73.29 82.45 1.37 Allowed 'General case' 0 N--CA 1.474 0.764 0 CA-C-O 122.413 1.102 . . . . 0.0 109.353 172.819 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 9.0 mptt -118.34 148.1 42.83 Favored 'General case' 0 C--O 1.238 0.476 0 CA-C-N 114.312 -1.313 . . . . 0.0 109.395 -176.876 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -130.15 127.4 39.67 Favored 'General case' 0 C--O 1.238 0.489 0 C-N-CA 124.076 0.951 . . . . 0.0 108.824 -178.797 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -112.91 -174.0 2.36 Favored 'General case' 0 C--O 1.241 0.617 0 N-CA-C 108.113 -1.069 . . . . 0.0 108.113 174.918 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.492 ' HD3' ' OG ' ' B' ' 28' ' ' SER . 9.7 ptp180 -145.0 158.08 43.93 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 123.47 0.708 . . . . 0.0 109.837 -176.162 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.635 ' HB3' ' HB2' ' A' ' 3' ' ' GLN . . . . . . . . 0 C--O 1.245 0.863 0 N-CA-C 107.321 -1.363 . . . . 0.0 107.321 169.486 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.492 ' OG ' ' HD3' ' B' ' 26' ' ' ARG . 48.3 m -75.44 -13.73 60.4 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 120.352 -0.539 . . . . 0.0 111.442 173.04 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . 70.7 131.63 0.04 OUTLIER Pre-proline 0 CA--C 1.549 0.91 0 C-N-CA 125.834 1.654 . . . . 0.0 112.44 174.166 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 35.8 Cg_exo -60.39 -29.16 88.19 Favored 'Trans proline' 0 C--N 1.377 2.061 0 C-N-CA 122.398 2.065 . . . . 0.0 111.721 167.904 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -105.03 98.69 8.36 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 124.379 1.072 . . . . 0.0 109.632 176.919 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.1 t -155.36 139.36 16.37 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.776 0.831 . . . . 0.0 109.905 -178.634 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.533 1.198 0 CA-C-O 119.173 -0.793 . . . . 0.0 111.891 -179.246 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.69 0 N-CA-C 111.672 -0.571 . . . . 0.0 111.672 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 40.0 tt0 -123.24 93.33 3.92 Favored 'General case' 0 C--O 1.24 0.586 0 C-N-CA 123.62 0.768 . . . . 0.0 108.966 -179.036 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 63.2 tt0 -152.0 102.35 2.8 Favored 'General case' 0 CA--C 1.541 0.611 0 C-N-CA 123.336 0.654 . . . . 0.0 109.686 -178.465 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.5 t -109.68 144.32 18.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.725 0 C-N-CA 124.273 1.029 . . . . 0.0 108.612 177.967 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.548 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 72.8 m-85 -128.97 160.73 31.77 Favored 'General case' 0 N--CA 1.477 0.881 0 N-CA-C 108.729 -0.841 . . . . 0.0 108.729 167.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.48 114.13 10.27 Favored 'General case' 0 C--O 1.242 0.673 0 N-CA-C 107.724 -1.213 . . . . 0.0 107.724 166.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.414 HG12 ' O ' ' B' ' 23' ' ' LYS . 3.1 p -92.95 137.88 21.38 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.083 0.553 . . . . 0.0 111.331 -172.054 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.653 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 35.8 tt0 -63.12 -59.56 4.61 Favored 'General case' 0 N--CA 1.476 0.856 0 C-N-CA 123.714 0.806 . . . . 0.0 109.496 174.487 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 22.3 p -176.73 176.53 1.5 Allowed 'General case' 0 C--O 1.24 0.56 0 CA-C-N 113.621 -1.627 . . . . 0.0 108.844 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.522 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.4 mm -82.95 115.6 25.71 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.507 0 N-CA-C 107.704 -1.221 . . . . 0.0 107.704 170.071 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.63 -53.56 18.13 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.184 0.594 . . . . 0.0 110.279 -179.927 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 62.5 mttp -133.96 166.32 22.98 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.565 0.746 . . . . 0.0 110.566 -178.795 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.9 tttt -151.06 142.2 23.15 Favored 'General case' 0 N--CA 1.465 0.278 0 N-CA-C 107.472 -1.307 . . . . 0.0 107.472 -179.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.1 ptm180 -154.42 173.23 16.52 Favored 'General case' 0 C--N 1.326 -0.44 0 C-N-CA 123.447 0.699 . . . . 0.0 109.318 -178.521 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.3 p -144.03 125.03 9.61 Favored 'Isoleucine or valine' 0 C--O 1.244 0.791 0 N-CA-C 108.627 -0.879 . . . . 0.0 108.627 174.966 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 28.3 ptt180 -139.9 122.22 15.99 Favored 'General case' 0 CA--C 1.536 0.409 0 C-N-CA 123.651 0.78 . . . . 0.0 109.296 178.489 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 57.5 tttm 62.62 26.45 15.68 Favored 'General case' 0 CA--C 1.56 1.363 0 C-N-CA 124.853 1.261 . . . . 0.0 110.667 -178.616 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 90.46 -8.01 80.49 Favored Glycine 0 C--N 1.354 1.543 0 CA-C-N 115.355 -0.839 . . . . 0.0 113.712 179.869 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.413 ' HA ' ' HD3' ' A' ' 19' ' ' LYS . 70.2 mmtt -89.77 112.96 24.42 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 117.252 0.526 . . . . 0.0 110.858 179.114 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.2 t -89.36 108.33 19.05 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.46 0 CA-C-N 115.322 -0.853 . . . . 0.0 109.37 -178.515 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 51.4 mt-10 -96.76 155.73 16.65 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.243 0.617 . . . . 0.0 110.738 -177.772 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.522 ' HB3' HD12 ' A' ' 10' ' ' ILE . 66.2 m-85 -132.99 112.22 11.66 Favored 'General case' 0 CA--C 1.534 0.329 0 C-N-CA 124.142 0.977 . . . . 0.0 108.693 178.939 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 27.7 tp -69.26 90.58 0.5 Allowed 'General case' 0 N--CA 1.476 0.858 0 N-CA-C 108.593 -0.891 . . . . 0.0 108.593 172.617 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 94.1 t -74.26 106.91 4.41 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.521 0.728 . . . . 0.0 111.305 -173.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.0 tptp -82.8 107.25 15.29 Favored 'General case' 0 N--CA 1.467 0.392 0 N-CA-C 108.573 -0.899 . . . . 0.0 108.573 176.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.548 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 52.9 m95 -71.45 149.25 46.06 Favored 'General case' 0 CA--C 1.542 0.671 0 CA-C-N 116.215 -0.448 . . . . 0.0 109.853 177.287 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.653 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 26.7 ttpp -67.48 -65.43 0.69 Allowed 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 123.319 0.648 . . . . 0.0 112.614 -166.102 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -93.21 41.07 2.72 Favored Glycine 0 N--CA 1.467 0.763 0 CA-C-N 116.583 -0.28 . . . . 0.0 112.759 -179.819 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.512 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.7 m95 -139.57 133.97 16.03 Favored Pre-proline 0 N--CA 1.479 0.991 0 C-N-CA 123.715 0.806 . . . . 0.0 109.385 -179.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 23.5 Cg_endo -59.71 157.31 33.22 Favored 'Trans proline' 0 C--N 1.382 2.308 0 C-N-CA 122.775 2.317 . . . . 0.0 112.374 176.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 50.7 Cg_exo -57.55 -15.23 19.32 Favored 'Trans proline' 0 C--N 1.386 2.511 0 C-N-CA 124.046 3.164 . . . . 0.0 115.328 -172.754 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.3 ptpt -64.52 -25.19 67.88 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 112.138 0.421 . . . . 0.0 112.138 177.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 70.1 m-85 -87.39 -5.1 59.0 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.463 0.705 . . . . 0.0 112.619 -179.302 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 97.1 p -66.6 125.83 27.0 Favored 'General case' 0 CA--C 1.548 0.878 0 N-CA-C 109.799 -0.445 . . . . 0.0 109.799 179.667 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.426 HG21 HM22 ' B' ' 27' ' ' M3L . 21.4 p -118.36 135.91 54.05 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.692 0.797 . . . . 0.0 110.904 -173.239 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -68.81 85.4 0.32 Allowed 'General case' 0 C--N 1.356 0.874 0 C-N-CA 123.276 0.63 . . . . 0.0 109.389 174.488 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 45.9 mm-40 -100.64 102.83 20.63 Favored Pre-proline 0 C--O 1.236 0.352 0 N-CA-C 108.525 -0.917 . . . . 0.0 108.525 175.059 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 41.0 Cg_endo -62.91 178.92 0.86 Allowed 'Trans proline' 0 C--N 1.368 1.586 0 C-N-CA 122.513 2.142 . . . . 0.0 113.234 173.8 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -59.13 -24.19 62.79 Favored 'General case' 0 N--CA 1.485 1.314 0 N-CA-C 113.9 1.074 . . . . 0.0 113.9 -172.002 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 45.8 mp0 -73.84 -23.18 59.6 Favored 'General case' 0 N--CA 1.483 1.217 0 C-N-CA 123.175 0.59 . . . . 0.0 111.979 179.689 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 2.1 m-70 -94.56 -19.27 20.65 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 113.798 1.036 . . . . 0.0 113.798 -168.241 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.46 HG23 ' HA ' ' B' ' 25' ' ' ALA . 33.2 mm -90.81 149.36 4.08 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.108 0 C-N-CA 123.76 0.824 . . . . 0.0 110.613 -174.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.4 mt -86.34 -71.94 0.52 Allowed 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.214 0.606 . . . . 0.0 109.617 176.29 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.8 t70 -72.03 126.68 91.2 Favored Pre-proline 0 CA--C 1.562 1.407 0 N-CA-C 109.291 -0.633 . . . . 0.0 109.291 -179.533 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 91.8 Cg_endo -76.43 -23.23 11.71 Favored 'Trans proline' 0 C--N 1.372 1.774 0 C-N-CA 122.575 2.183 . . . . 0.0 113.796 -179.052 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.405 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 88.8 mtm180 -69.87 -12.83 61.92 Favored 'General case' 0 N--CA 1.49 1.562 0 C-N-CA 124.33 1.052 . . . . 0.0 113.59 -168.95 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.438 ' HB3' HG12 ' A' ' 10' ' ' ILE . 3.0 mm? -57.31 -40.63 78.26 Favored 'General case' 0 N--CA 1.493 1.695 0 CA-C-N 118.116 0.416 . . . . 0.0 110.693 171.525 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 42.4 t -65.63 -43.95 93.75 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.838 0 CA-C-N 115.23 -0.896 . . . . 0.0 110.059 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.426 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 1.5 mpt? -61.95 -50.58 71.56 Favored 'General case' 0 N--CA 1.481 1.096 0 CA-C-N 115.078 -0.964 . . . . 0.0 110.589 178.823 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.32 -34.97 74.55 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 124.283 1.033 . . . . 0.0 111.797 -177.229 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 84.6 t80 -64.34 -39.69 94.4 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 124.039 0.936 . . . . 0.0 110.926 175.003 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 -87.15 -10.68 52.1 Favored 'General case' 0 CA--C 1.547 0.841 0 C-N-CA 123.735 0.814 . . . . 0.0 111.942 -177.659 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.426 ' HG2' ' O ' ' A' ' 49' ' ' MET . 41.0 mm-40 -77.9 -34.93 51.25 Favored 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 122.856 0.463 . . . . 0.0 110.785 175.025 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.9 ptpt -83.07 -177.67 6.84 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 122.878 0.471 . . . . 0.0 110.615 179.24 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -77.11 109.83 11.27 Favored 'General case' 0 CA--C 1.539 0.54 0 C-N-CA 123.371 0.669 . . . . 0.0 109.459 175.945 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.562 1.433 0 C-N-CA 124.476 1.111 . . . . 0.0 109.832 -176.285 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 . . . . . 0 N--CA 1.483 1.182 0 N-CA-C 110.396 -0.224 . . . . 0.0 110.396 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 52.9 tp 62.95 93.83 0.05 Allowed 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 124.841 1.256 . . . . 0.0 109.88 -176.188 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -144.59 131.38 20.17 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.455 0.702 . . . . 0.0 109.54 -177.874 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 12.3 t -80.34 135.5 36.21 Favored 'General case' 0 CA--C 1.542 0.668 0 CA-C-O 121.551 0.691 . . . . 0.0 110.85 -177.733 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . 0.414 ' O ' HG12 ' A' ' 7' ' ' VAL . 0.0 OUTLIER -112.98 -174.04 2.37 Favored 'General case' 0 C--O 1.247 0.97 0 C-N-CA 124.359 1.064 . . . . 0.0 108.694 176.056 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -102.03 104.3 14.95 Favored 'General case' 0 N--CA 1.461 0.113 0 CA-C-O 121.164 0.506 . . . . 0.0 110.647 -177.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.46 ' HA ' HG23 ' A' ' 42' ' ' ILE . . . -103.85 142.34 34.57 Favored 'General case' 0 C--O 1.242 0.662 0 N-CA-C 107.342 -1.355 . . . . 0.0 107.342 164.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 50.5 ttt180 -132.21 149.99 52.26 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.104 0.561 . . . . 0.0 110.092 -172.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.426 HM22 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.539 0.555 0 CA-C-N 115.593 -0.731 . . . . 0.0 109.028 171.409 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 12.7 t 76.45 161.08 0.23 Allowed 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 124.346 1.058 . . . . 0.0 112.947 168.633 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . 66.36 90.24 0.09 OUTLIER Pre-proline 0 N--CA 1.483 1.204 0 C-N-CA 125.213 1.405 . . . . 0.0 110.876 -176.955 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -73.95 95.8 0.91 Allowed 'Trans proline' 0 C--N 1.374 1.87 0 C-N-CA 122.371 2.047 . . . . 0.0 111.478 -179.197 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.06 95.33 0.38 Allowed 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.209 0.604 . . . . 0.0 110.615 179.907 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 26.5 m -72.07 114.89 10.65 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.473 0.709 . . . . 0.0 111.518 -176.519 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.245 0.811 0 N-CA-C 109.929 -1.268 . . . . 0.0 109.929 179.616 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.419 0 N-CA-C 111.722 -0.551 . . . . 0.0 111.722 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.551 ' HB2' ' HD2' ' B' ' 26' ' ' ARG . 15.2 pt-20 -81.83 97.62 8.09 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-O 121.453 0.644 . . . . 0.0 109.534 178.101 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.475 ' HB2' ' HB3' ' B' ' 27' ' ' M3L . 83.8 mt-30 -82.45 79.34 8.92 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.493 0.717 . . . . 0.0 110.635 -175.592 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 46.0 t -83.65 125.01 40.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.731 0 C-N-CA 124.482 1.113 . . . . 0.0 109.512 -179.913 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.401 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 68.8 m-85 -133.44 147.01 51.68 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.937 0.495 . . . . 0.0 110.421 176.952 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.66 111.32 4.73 Favored 'General case' 0 C--O 1.241 0.623 0 N-CA-C 108.539 -0.912 . . . . 0.0 108.539 169.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.1 p -89.37 144.14 9.72 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.647 0 C-N-CA 123.685 0.794 . . . . 0.0 110.736 -176.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -81.92 -61.19 1.99 Allowed 'General case' 0 CA--C 1.54 0.578 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.739 177.951 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 56.6 m -158.35 171.58 19.91 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.937 0.895 . . . . 0.0 110.221 -174.7 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.468 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 34.7 mm -92.81 117.5 36.35 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.577 0 N-CA-C 107.142 -1.429 . . . . 0.0 107.142 163.534 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -76.01 -46.91 27.02 Favored 'General case' 0 N--CA 1.474 0.735 0 C-N-CA 123.944 0.898 . . . . 0.0 109.887 -177.536 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -151.65 166.1 32.3 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 123.532 0.733 . . . . 0.0 109.765 -176.61 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.8 tttt -146.97 152.21 38.26 Favored 'General case' 0 CA--C 1.544 0.719 0 C-N-CA 124.242 1.017 . . . . 0.0 109.68 -176.807 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 4.4 ptm180 -165.15 167.69 17.91 Favored 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 125.367 1.467 . . . . 0.0 108.526 175.145 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 13.6 p -118.42 145.35 24.52 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 108.628 -0.878 . . . . 0.0 108.628 172.898 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 35.4 ttt180 -142.81 96.02 2.87 Favored 'General case' 0 CA--C 1.539 0.554 0 C-N-CA 123.178 0.591 . . . . 0.0 109.602 -174.491 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.2 mmtm 55.96 39.19 30.58 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.546 1.138 . . . . 0.0 111.554 178.148 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.48 -19.51 52.2 Favored Glycine 0 C--N 1.346 1.117 0 CA-C-N 114.732 -1.122 . . . . 0.0 113.752 -179.921 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.0 mttm -85.75 108.29 18.01 Favored 'General case' 0 N--CA 1.48 1.038 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 175.661 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.454 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 11.3 t -85.9 109.77 18.96 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.393 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 -175.29 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 26.5 mm-40 -93.82 136.53 34.01 Favored 'General case' 0 N--CA 1.471 0.604 0 C-N-CA 123.896 0.878 . . . . 0.0 109.657 -170.38 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 32.6 m-85 -124.48 122.79 38.61 Favored 'General case' 0 N--CA 1.474 0.73 0 N-CA-C 108.602 -0.888 . . . . 0.0 108.602 -179.579 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 32.4 tp -71.63 85.87 0.89 Allowed 'General case' 0 N--CA 1.467 0.384 0 N-CA-C 107.676 -1.231 . . . . 0.0 107.676 170.009 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.614 HG21 HD11 ' A' ' 42' ' ' ILE . 65.8 t -77.43 107.03 8.35 Favored 'Isoleucine or valine' 0 C--O 1.241 0.617 0 CA-C-N 115.396 -0.82 . . . . 0.0 109.741 -173.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.1 tptm -74.54 102.84 4.65 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 175.233 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.604 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.7 m95 -74.18 138.0 43.49 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 114.945 -1.025 . . . . 0.0 109.498 177.132 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 21.5 ttpp -77.95 -17.9 56.66 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.008 0.523 . . . . 0.0 111.35 -172.223 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -111.37 13.76 28.08 Favored Glycine 0 C--N 1.346 1.116 0 C-N-CA 123.107 0.384 . . . . 0.0 112.994 178.578 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.604 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.2 m95 -130.88 147.16 65.14 Favored Pre-proline 0 N--CA 1.482 1.173 0 C-N-CA 123.592 0.757 . . . . 0.0 110.537 178.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_exo -55.13 157.26 14.12 Favored 'Trans proline' 0 C--N 1.38 2.212 0 C-N-CA 123.212 2.608 . . . . 0.0 113.254 169.063 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -63.92 -16.74 56.6 Favored 'Trans proline' 0 C--N 1.384 2.409 0 C-N-CA 123.122 2.548 . . . . 0.0 113.338 -179.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -82.67 -27.94 30.98 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.009 0.524 . . . . 0.0 111.465 175.651 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.4 m-85 -86.76 -1.43 57.74 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.628 0.771 . . . . 0.0 111.174 175.557 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 41.6 m -67.11 117.99 9.91 Favored 'General case' 0 C--N 1.348 0.542 0 N-CA-C 108.751 -0.833 . . . . 0.0 108.751 170.362 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.559 HG21 HM12 ' B' ' 27' ' ' M3L . 23.0 p -106.58 151.66 24.73 Favored 'General case' 0 C--O 1.24 0.603 0 C-N-CA 123.361 0.664 . . . . 0.0 111.269 -172.505 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 89.5 m95 -79.19 89.28 4.87 Favored 'General case' 0 N--CA 1.47 0.568 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.281 178.845 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 54.9 mm-40 -100.45 119.1 59.76 Favored Pre-proline 0 C--O 1.239 0.53 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 177.47 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.0 Cg_endo -69.46 171.23 14.5 Favored 'Trans proline' 0 C--N 1.371 1.732 0 C-N-CA 122.296 1.998 . . . . 0.0 112.073 173.637 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.9 pt-20 -61.9 -19.45 62.68 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 123.654 0.782 . . . . 0.0 112.13 177.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.499 ' O ' ' HD3' ' B' ' 30' ' ' PRO . 30.5 tt0 -56.88 -46.59 81.76 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 123.993 0.917 . . . . 0.0 110.224 168.997 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 64.8 m170 -85.47 -25.23 27.03 Favored 'General case' 0 C--O 1.241 0.653 0 CA-C-N 115.497 -0.774 . . . . 0.0 112.666 -172.835 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.614 HD11 HG21 ' A' ' 24' ' ' VAL . 48.1 mm -81.84 146.21 7.61 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.282 0 C-N-CA 123.599 0.76 . . . . 0.0 111.624 -174.69 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 94.1 mt -86.47 -61.92 1.63 Allowed 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.678 0.791 . . . . 0.0 110.098 173.029 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 8.7 t0 -72.55 112.68 15.93 Favored Pre-proline 0 CA--C 1.553 1.089 0 C-N-CA 123.397 0.679 . . . . 0.0 110.161 -172.592 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 89.9 Cg_endo -78.49 -24.49 7.59 Favored 'Trans proline' 0 C--N 1.374 1.873 0 C-N-CA 122.582 2.188 . . . . 0.0 112.582 178.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 55.2 mtm180 -72.89 -21.15 60.96 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.271 1.028 . . . . 0.0 109.71 -177.539 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 44.5 tp -55.22 -48.64 73.6 Favored 'General case' 0 N--CA 1.471 0.584 0 C-N-CA 125.354 1.461 . . . . 0.0 112.234 -178.571 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 53.7 t -68.92 -36.03 72.11 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 CA-C-N 115.039 -0.982 . . . . 0.0 111.216 -177.505 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.402 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 92.6 mmm -55.86 -45.51 78.48 Favored 'General case' 0 N--CA 1.482 1.143 0 O-C-N 124.086 0.866 . . . . 0.0 110.666 178.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -55.58 -33.43 63.89 Favored 'General case' 0 N--CA 1.488 1.463 0 C-N-CA 123.964 0.905 . . . . 0.0 112.454 -178.205 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.468 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 86.1 t80 -75.44 -46.03 35.11 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.113 0.965 . . . . 0.0 110.389 175.401 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -71.53 -11.89 61.1 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.652 0.781 . . . . 0.0 112.899 -174.098 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 49' ' ' MET . 11.0 mm-40 -58.44 -32.25 68.53 Favored 'General case' 0 N--CA 1.481 1.088 0 CA-C-O 121.323 0.582 . . . . 0.0 109.821 172.645 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.402 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 0.1 OUTLIER -88.5 108.0 19.17 Favored 'General case' 0 CA--C 1.543 0.676 0 N-CA-C 108.088 -1.079 . . . . 0.0 108.088 173.043 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 41.7 mt-10 66.92 81.14 0.2 Allowed 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 125.42 1.488 . . . . 0.0 111.086 -179.494 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 . . . . . 0 CA--C 1.558 1.288 0 CA-C-N 114.747 -1.115 . . . . 0.0 109.761 179.646 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 . . . . . 0 N--CA 1.482 1.146 0 N-CA-C 109.881 -0.415 . . . . 0.0 109.881 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 55.3 tp -78.39 144.74 35.65 Favored 'General case' 0 C--O 1.243 0.74 0 C-N-CA 123.379 0.672 . . . . 0.0 109.731 176.792 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.29 119.42 5.45 Favored 'General case' 0 CA--C 1.541 0.612 0 C-N-CA 123.197 0.599 . . . . 0.0 110.536 -177.458 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 26.9 m -87.33 86.84 7.29 Favored 'General case' 0 CA--C 1.543 0.698 0 N-CA-C 108.886 -0.783 . . . . 0.0 108.886 175.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.2 mtpt -109.05 146.81 33.36 Favored 'General case' 0 N--CA 1.476 0.848 0 C-N-CA 124.18 0.992 . . . . 0.0 108.661 -176.573 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -119.91 113.09 20.03 Favored 'General case' 0 C--O 1.232 0.144 0 C-N-CA 122.897 0.479 . . . . 0.0 110.232 -176.77 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.463 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -96.4 172.66 7.8 Favored 'General case' 0 C--O 1.246 0.887 0 N-CA-C 108.817 -0.809 . . . . 0.0 108.817 169.486 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.551 ' HD2' ' HB2' ' A' ' 2' ' ' GLU . 49.7 ttp180 -152.59 158.09 41.96 Favored 'General case' 0 N--CA 1.467 0.386 0 CA-C-O 120.968 0.413 . . . . 0.0 110.132 -175.426 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.559 HM12 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.537 0.473 0 C-N-CA 123.639 0.776 . . . . 0.0 111.319 178.072 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 13.6 m -140.76 135.56 31.64 Favored 'General case' 0 N--CA 1.483 1.223 0 O-C-N 122.038 -0.414 . . . . 0.0 111.701 -167.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -68.56 154.48 94.44 Favored Pre-proline 0 CA--C 1.56 1.348 0 C-N-CA 124.13 0.972 . . . . 0.0 111.076 176.39 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . 0.499 ' HD3' ' O ' ' A' ' 40' ' ' GLU . 38.7 Cg_exo -60.12 112.76 1.4 Allowed 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 123.038 2.492 . . . . 0.0 112.237 178.882 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.97 106.65 1.29 Allowed 'General case' 0 N--CA 1.473 0.693 0 C-N-CA 123.812 0.845 . . . . 0.0 110.858 -179.851 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 15.4 t -155.86 21.87 0.39 Allowed 'General case' 0 CA--C 1.553 1.075 0 C-N-CA 124.08 0.952 . . . . 0.0 110.231 178.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.53 1.02 0 CA-C-O 118.91 -0.939 . . . . 0.0 111.512 -179.01 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.312 0 N-CA-C 111.867 -0.493 . . . . 0.0 111.867 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.5 mp0 -86.86 6.05 33.76 Favored 'General case' 0 N--CA 1.483 1.177 0 C-N-CA 123.848 0.859 . . . . 0.0 111.806 -176.974 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -60.98 118.45 6.74 Favored 'General case' 0 CA--C 1.551 1.018 0 C-N-CA 123.395 0.678 . . . . 0.0 112.174 -175.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 35.9 t -102.15 121.36 53.09 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.527 0 C-N-CA 125.022 1.329 . . . . 0.0 107.978 172.631 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.427 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 52.4 m-85 -127.13 155.09 43.89 Favored 'General case' 0 N--CA 1.484 1.245 0 CA-C-N 118.065 0.393 . . . . 0.0 110.338 176.74 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.97 114.75 6.78 Favored 'General case' 0 C--O 1.24 0.579 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.82 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.464 HG13 HD11 ' A' ' 47' ' ' LEU . 4.1 p -103.97 137.52 32.38 Favored 'Isoleucine or valine' 0 C--O 1.244 0.815 0 C-N-CA 124.116 0.967 . . . . 0.0 111.073 -173.053 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.589 ' HA ' ' HB1' ' B' ' 21' ' ' ALA . 32.0 tt0 -74.87 -63.03 1.35 Allowed 'General case' 0 CA--C 1.537 0.467 0 CA-C-N 115.409 -0.814 . . . . 0.0 110.924 -177.554 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 74.7 m -165.48 -177.65 4.54 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.941 0.896 . . . . 0.0 110.385 -173.037 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.55 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.9 mm -86.95 109.68 19.44 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.657 0 N-CA-C 108.021 -1.103 . . . . 0.0 108.021 169.301 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.628 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -68.76 -49.62 57.17 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 124.848 1.259 . . . . 0.0 109.408 -178.316 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 41.5 mttp -146.03 168.96 19.64 Favored 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.407 1.083 . . . . 0.0 109.788 178.116 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 75.0 tttt -155.18 138.73 15.97 Favored 'General case' 0 N--CA 1.468 0.456 0 C-N-CA 123.969 0.908 . . . . 0.0 108.897 -177.319 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 5.3 ptm180 -165.56 139.78 4.7 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 123.64 0.776 . . . . 0.0 109.714 174.532 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 9.6 p -90.97 118.63 36.6 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.936 0 CA-C-O 121.256 0.55 . . . . 0.0 110.625 -178.209 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 48.7 mtp180 -107.53 101.3 10.64 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.022 0.929 . . . . 0.0 109.615 176.622 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 94.9 mttt 59.45 40.96 20.08 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 125.065 1.346 . . . . 0.0 112.642 174.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.81 -17.64 57.47 Favored Glycine 0 N--CA 1.472 1.035 0 CA-C-N 115.533 -0.758 . . . . 0.0 113.232 178.537 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 96.3 mttt -90.49 110.92 22.03 Favored 'General case' 0 N--CA 1.47 0.538 0 N-CA-C 109.354 -0.61 . . . . 0.0 109.354 176.273 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.3 t -81.82 111.4 18.29 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 N-CA-C 109.156 -0.683 . . . . 0.0 109.156 -175.256 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 14.8 mm-40 -93.78 137.94 32.5 Favored 'General case' 0 C--O 1.239 0.546 0 C-N-CA 123.913 0.885 . . . . 0.0 109.474 -173.148 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.55 ' HB3' HD12 ' A' ' 10' ' ' ILE . 72.6 m-85 -121.61 114.73 21.59 Favored 'General case' 0 N--CA 1.465 0.313 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 179.77 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.54 HD23 ' HD2' ' A' ' 11' ' ' ARG . 23.6 tp -70.55 93.62 0.92 Allowed 'General case' 0 CA--C 1.533 0.295 0 N-CA-C 108.026 -1.102 . . . . 0.0 108.026 170.273 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 73.5 t -70.73 105.84 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.465 0 C-N-CA 124.659 1.184 . . . . 0.0 110.571 -175.882 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.628 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 21.0 tptm -78.63 101.06 7.27 Favored 'General case' 0 C--O 1.234 0.239 0 N-CA-C 108.12 -1.067 . . . . 0.0 108.12 172.891 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.504 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 74.1 m95 -69.09 141.23 54.78 Favored 'General case' 0 CA--C 1.54 0.562 0 N-CA-C 108.71 -0.848 . . . . 0.0 108.71 173.753 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 35.3 ttpt -76.65 -39.56 51.86 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.835 -0.432 . . . . 0.0 109.835 178.967 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -70.95 -47.96 35.89 Favored Glycine 0 C--N 1.351 1.391 0 CA-C-N 115.471 -0.786 . . . . 0.0 112.212 178.339 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.504 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.9 m95 -87.24 136.31 33.76 Favored Pre-proline 0 N--CA 1.479 0.994 0 C-N-CA 123.455 0.702 . . . . 0.0 110.491 -177.987 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 31.6 Cg_endo -60.42 164.05 13.83 Favored 'Trans proline' 0 CA--C 1.569 2.262 0 C-N-CA 123.081 2.521 . . . . 0.0 112.034 177.835 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 71.5 Cg_exo -53.53 -19.33 13.41 Favored 'Trans proline' 0 C--N 1.39 2.744 0 C-N-CA 124.059 3.173 . . . . 0.0 115.562 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.5 ptpt -71.58 -27.51 63.19 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 122.634 0.374 . . . . 0.0 111.991 178.107 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.424 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 67.6 m-85 -97.19 12.39 33.0 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 123.425 0.69 . . . . 0.0 111.857 178.741 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -64.77 122.77 17.67 Favored 'General case' 0 CA--C 1.55 0.945 0 N-CA-C 109.414 -0.587 . . . . 0.0 109.414 173.841 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 24.7 p -101.55 128.8 47.63 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.877 0.871 . . . . 0.0 111.005 -173.716 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.0 m95 -68.8 83.49 0.3 Allowed 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 171.811 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.498 ' HB3' ' HB2' ' A' ' 41' ' ' HIS . 29.0 mm-40 -106.85 116.82 58.07 Favored Pre-proline 0 N--CA 1.468 0.463 0 N-CA-C 108.814 -0.81 . . . . 0.0 108.814 174.994 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -66.1 174.96 5.23 Favored 'Trans proline' 0 C--N 1.362 1.243 0 C-N-CA 122.064 1.843 . . . . 0.0 111.421 168.619 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -56.84 -19.07 15.44 Favored 'General case' 0 N--CA 1.489 1.519 0 C-N-CA 124.495 1.118 . . . . 0.0 112.858 175.609 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 41.4 mt-10 -59.73 -22.89 62.68 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 125.127 1.371 . . . . 0.0 112.078 173.608 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.498 ' HB2' ' HB3' ' A' ' 37' ' ' GLU . 66.8 m-70 -117.04 -16.47 10.48 Favored 'General case' 0 N--CA 1.482 1.165 0 C-N-CA 124.149 0.98 . . . . 0.0 112.176 -174.094 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 38.2 mm -82.26 140.92 15.74 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.193 0 C-N-CA 122.905 0.482 . . . . 0.0 110.626 -174.653 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 90.5 mt -87.91 -70.73 0.61 Allowed 'General case' 0 C--N 1.351 0.655 0 N-CA-C 109.433 -0.58 . . . . 0.0 109.433 172.74 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 18.2 t70 -72.73 126.63 90.59 Favored Pre-proline 0 CA--C 1.557 1.246 0 CA-C-N 116.177 -0.465 . . . . 0.0 111.113 -172.678 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 76.0 Cg_endo -80.13 -17.6 10.45 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.865 2.377 . . . . 0.0 113.828 -177.515 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.643 ' HA ' ' HG2' ' A' ' 49' ' ' MET . 87.1 mtm180 -69.82 -16.38 63.26 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 123.247 0.619 . . . . 0.0 111.887 -173.866 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.464 HD11 HG13 ' A' ' 7' ' ' VAL . 4.3 mm? -58.02 -53.75 54.68 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.346 0.658 . . . . 0.0 110.457 172.263 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 60.7 t -70.69 -53.06 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.246 0 CA-C-N 114.515 -1.221 . . . . 0.0 109.85 -171.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.643 ' HG2' ' HA ' ' A' ' 46' ' ' ARG . 25.6 ptm -59.18 -33.34 70.82 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.722 0.639 . . . . 0.0 112.086 -174.998 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.97 -49.56 74.24 Favored 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 109.609 -0.515 . . . . 0.0 109.609 178.043 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 90.6 t80 -66.13 -30.95 71.54 Favored 'General case' 0 CA--C 1.551 1.012 0 CA-C-N 115.16 -0.927 . . . . 0.0 111.004 178.142 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 25.3 mm-40 -74.97 -18.88 60.31 Favored 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 123.788 0.835 . . . . 0.0 111.586 179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 40.0 mm-40 -77.12 -10.59 59.49 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.94 0.496 . . . . 0.0 111.544 173.666 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -134.15 175.08 9.81 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 123.055 0.542 . . . . 0.0 111.174 178.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 43.5 mt-10 -131.75 100.42 5.1 Favored 'General case' 0 N--CA 1.47 0.539 0 N-CA-C 107.381 -1.341 . . . . 0.0 107.381 166.602 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 63.9 mm-40 . . . . . 0 C--O 1.251 1.134 0 C-N-CA 123.506 0.722 . . . . 0.0 111.014 -174.133 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 46.4 mt-30 . . . . . 0 N--CA 1.476 0.837 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 6.0 mp -75.47 167.39 21.99 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 122.906 0.483 . . . . 0.0 110.397 -179.321 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.589 ' HB1' ' HA ' ' A' ' 8' ' ' GLU . . . -91.22 19.64 5.74 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.579 0.752 . . . . 0.0 111.771 -179.269 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 18.6 m -87.08 67.62 9.77 Favored 'General case' 0 N--CA 1.477 0.899 0 CA-C-O 122.277 1.037 . . . . 0.0 110.579 -177.964 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -140.07 161.81 36.73 Favored 'General case' 0 C--O 1.243 0.76 0 N-CA-C 106.0 -1.852 . . . . 0.0 106.0 171.903 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -127.55 123.8 36.68 Favored 'General case' 0 N--CA 1.467 0.4 0 CA-C-O 121.448 0.642 . . . . 0.0 111.297 -176.757 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -97.92 168.42 10.31 Favored 'General case' 0 C--O 1.249 1.058 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 167.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -141.53 166.22 25.36 Favored 'General case' 0 C--N 1.319 -0.754 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 -176.007 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.545 0.778 0 CA-C-N 115.806 -0.634 . . . . 0.0 110.841 175.908 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 25.0 p 178.1 147.47 0.15 Allowed 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 124.33 1.052 . . . . 0.0 110.357 -175.275 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -83.11 157.12 66.37 Favored Pre-proline 0 N--CA 1.48 1.071 0 N-CA-C 108.574 -0.898 . . . . 0.0 108.574 167.68 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 75.7 Cg_exo -51.75 108.92 0.27 Allowed 'Trans proline' 0 C--N 1.374 1.907 0 C-N-CA 122.323 2.015 . . . . 0.0 110.767 170.503 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.85 -22.99 67.08 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 124.07 0.948 . . . . 0.0 113.034 -168.245 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.1 m 62.08 33.53 17.02 Favored 'General case' 0 N--CA 1.486 1.335 0 CA-C-O 122.585 1.184 . . . . 0.0 110.453 176.173 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.38 0 CA-C-N 114.744 -1.116 . . . . 0.0 111.961 -178.138 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.528 ' HA2' ' HA ' ' B' ' 28' ' ' SER . . . . . . . . 0 N--CA 1.477 1.396 0 N-CA-C 111.943 -0.463 . . . . 0.0 111.943 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.3 tt0 -95.79 -55.34 3.03 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.372 0.669 . . . . 0.0 110.322 -173.719 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.0 mp0 -115.97 153.28 31.91 Favored 'General case' 0 N--CA 1.485 1.302 0 C-N-CA 122.92 0.488 . . . . 0.0 110.538 175.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 47.9 t -133.85 128.24 53.34 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 107.369 -1.345 . . . . 0.0 107.369 167.785 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.568 ' HE2' HM33 ' B' ' 27' ' ' M3L . 63.6 m-85 -138.07 166.8 23.21 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.224 0.61 . . . . 0.0 109.84 175.142 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.92 151.38 44.76 Favored 'General case' 0 C--O 1.245 0.83 0 CA-C-N 115.475 -0.784 . . . . 0.0 109.42 171.559 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.485 HG13 HD11 ' A' ' 47' ' ' LEU . 2.5 p -138.49 133.41 42.6 Favored 'Isoleucine or valine' 0 C--O 1.24 0.601 0 C-N-CA 124.097 0.959 . . . . 0.0 109.479 -176.898 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.457 ' O ' ' HB3' ' B' ' 21' ' ' ALA . 10.7 tp10 -72.64 -50.5 24.77 Favored 'General case' 0 CA--C 1.539 0.531 0 CA-C-N 115.592 -0.731 . . . . 0.0 109.91 178.404 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 25.3 p -174.25 175.36 2.68 Favored 'General case' 0 C--O 1.245 0.816 0 C-N-CA 124.336 1.054 . . . . 0.0 110.047 179.817 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.592 HD12 ' HB3' ' A' ' 22' ' ' TYR . 40.2 mm -78.67 116.9 23.22 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.331 0 N-CA-C 107.551 -1.277 . . . . 0.0 107.551 168.226 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 1.6 tmt_? -64.61 -56.24 15.14 Favored 'General case' 0 CA--C 1.557 1.219 0 C-N-CA 124.306 1.042 . . . . 0.0 109.179 179.112 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 58.6 mtpt -141.26 165.94 26.13 Favored 'General case' 0 N--CA 1.488 1.438 0 C-N-CA 124.11 0.964 . . . . 0.0 110.195 -178.263 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 78.7 tttt -146.62 139.19 25.12 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.652 0.781 . . . . 0.0 109.71 -173.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 0.7 OUTLIER -157.34 170.9 21.42 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 124.866 1.266 . . . . 0.0 108.49 -179.749 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 17.3 t -129.16 132.88 66.67 Favored 'Isoleucine or valine' 0 N--CA 1.496 1.835 0 CA-C-N 118.665 0.666 . . . . 0.0 109.627 177.257 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.417 ' HG2' ' HG3' ' A' ' 17' ' ' LYS . 66.4 ttt180 -144.15 122.89 12.61 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.546 0.739 . . . . 0.0 109.231 -177.955 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.417 ' HG3' ' HG2' ' A' ' 16' ' ' ARG . 93.1 mttt 65.24 26.63 12.25 Favored 'General case' 0 N--CA 1.493 1.701 0 C-N-CA 124.752 1.221 . . . . 0.0 111.76 176.746 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.85 -10.8 72.54 Favored Glycine 0 CA--C 1.532 1.135 0 CA-C-N 115.772 -0.649 . . . . 0.0 112.866 -176.916 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -98.79 115.12 28.08 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.844 0.858 . . . . 0.0 110.471 -176.008 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 21.4 t -77.4 112.09 14.95 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.645 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 -179.947 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.4 mt-10 -92.23 143.44 26.41 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 124.187 0.995 . . . . 0.0 109.679 -175.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.592 ' HB3' HD12 ' A' ' 10' ' ' ILE . 66.8 m-85 -129.96 117.54 20.25 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 109.047 -0.723 . . . . 0.0 109.047 -179.14 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.0 tp -68.63 89.09 0.36 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.404 -0.961 . . . . 0.0 108.404 172.243 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.557 HG21 HD11 ' A' ' 42' ' ' ILE . 97.4 t -74.65 107.89 5.71 Favored 'Isoleucine or valine' 0 C--O 1.241 0.627 0 C-N-CA 123.594 0.758 . . . . 0.0 110.526 -174.477 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.3 tptp -79.45 100.25 7.59 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.781 -0.822 . . . . 0.0 108.781 176.441 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.543 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 80.1 m95 -68.19 127.42 32.86 Favored 'General case' 0 CA--C 1.536 0.412 0 CA-C-N 115.539 -0.755 . . . . 0.0 109.071 178.57 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 20.9 ttpp -64.8 -41.18 96.01 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.985 0.914 . . . . 0.0 112.027 -166.136 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.43 18.81 52.97 Favored Glycine 0 N--CA 1.474 1.231 0 CA-C-N 116.016 -0.538 . . . . 0.0 113.578 -179.048 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.543 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 87.9 m95 -129.79 140.7 39.43 Favored Pre-proline 0 N--CA 1.484 1.256 0 C-N-CA 123.798 0.839 . . . . 0.0 109.861 177.837 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.435 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 80.1 Cg_exo -51.91 154.33 10.24 Favored 'Trans proline' 0 C--N 1.382 2.315 0 C-N-CA 123.544 2.829 . . . . 0.0 113.989 175.109 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.5 Cg_exo -53.65 -24.19 28.75 Favored 'Trans proline' 0 C--N 1.386 2.514 0 C-N-CA 123.949 3.1 . . . . 0.0 114.841 178.729 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.435 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 58.6 pttt -66.42 -28.55 68.7 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 122.675 0.39 . . . . 0.0 111.471 179.233 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 43.9 m-85 -88.94 2.38 53.95 Favored 'General case' 0 N--CA 1.487 1.388 0 C-N-CA 123.352 0.661 . . . . 0.0 112.15 179.706 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 96.7 p -67.3 117.32 9.15 Favored 'General case' 0 C--N 1.356 0.883 0 N-CA-C 108.581 -0.896 . . . . 0.0 108.581 175.995 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.504 HG21 HM12 ' B' ' 27' ' ' M3L . 20.3 p -108.22 136.42 47.91 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.859 0.864 . . . . 0.0 110.506 -173.907 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -69.89 80.62 0.46 Allowed 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 123.413 0.685 . . . . 0.0 110.173 176.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.503 ' HB2' HD11 ' A' ' 42' ' ' ILE . 15.4 mm-40 -94.67 116.0 65.92 Favored Pre-proline 0 C--O 1.239 0.508 0 C-N-CA 123.63 0.772 . . . . 0.0 109.025 177.417 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 43.1 Cg_endo -66.0 172.19 8.91 Favored 'Trans proline' 0 C--N 1.368 1.556 0 C-N-CA 121.992 1.795 . . . . 0.0 112.19 172.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -54.13 -28.67 41.3 Favored 'General case' 0 N--CA 1.494 1.76 0 C-N-CA 124.687 1.195 . . . . 0.0 112.355 -179.172 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 35.1 mt-10 -59.66 -34.81 73.32 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.185 1.394 . . . . 0.0 111.709 178.976 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.735 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 11.4 m170 -85.05 -31.55 23.35 Favored 'General case' 0 C--O 1.238 0.5 0 CA-C-N 115.071 -0.968 . . . . 0.0 111.507 -173.763 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.557 HD11 HG21 ' A' ' 24' ' ' VAL . 36.9 mm -86.62 144.49 9.27 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.109 0 C-N-CA 124.061 0.944 . . . . 0.0 111.666 -167.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 80.5 mt -78.07 -72.14 0.38 Allowed 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.543 0.737 . . . . 0.0 110.513 173.835 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 12.7 t70 -74.33 117.75 64.31 Favored Pre-proline 0 CA--C 1.557 1.227 0 N-CA-C 108.829 -0.804 . . . . 0.0 108.829 -175.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 97.9 Cg_endo -78.3 -15.91 14.0 Favored 'Trans proline' 0 C--N 1.37 1.696 0 C-N-CA 122.427 2.085 . . . . 0.0 112.893 -177.734 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 82.9 mtm180 -72.76 -12.45 61.01 Favored 'General case' 0 N--CA 1.471 0.581 0 C-N-CA 123.713 0.805 . . . . 0.0 111.981 -173.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.485 HD11 HG13 ' A' ' 7' ' ' VAL . 3.1 mm? -50.95 -45.06 60.55 Favored 'General case' 0 N--CA 1.5 2.028 0 C-N-CA 123.048 0.539 . . . . 0.0 110.885 168.163 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.4 t -61.24 -49.88 82.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 CA-C-N 114.79 -1.096 . . . . 0.0 110.387 -176.88 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.1 mmt -68.83 -37.24 79.04 Favored 'General case' 0 N--CA 1.473 0.705 0 CA-C-N 114.707 -1.133 . . . . 0.0 111.089 -178.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -64.63 -39.53 93.87 Favored 'General case' 0 N--CA 1.485 1.282 0 C-N-CA 123.833 0.853 . . . . 0.0 111.017 179.959 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.473 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 18.8 t80 -61.92 -53.29 57.82 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 123.857 0.863 . . . . 0.0 110.667 174.716 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -69.8 -36.85 76.03 Favored 'General case' 0 C--O 1.221 -0.447 0 CA-C-N 115.383 -0.826 . . . . 0.0 112.4 -170.674 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -64.1 -32.76 74.44 Favored 'General case' 0 N--CA 1.489 1.519 0 CA-C-N 118.097 0.408 . . . . 0.0 111.296 -178.686 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.5 mtpm? -71.45 -26.16 62.6 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.685 0.794 . . . . 0.0 110.944 175.917 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 30.7 tt0 -92.84 -17.0 24.63 Favored 'General case' 0 CA--C 1.556 1.196 0 C-N-CA 123.808 0.843 . . . . 0.0 111.464 179.141 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.6 mm-40 . . . . . 0 N--CA 1.48 1.058 0 C-N-CA 124.04 0.936 . . . . 0.0 108.579 176.879 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 87.2 mm-40 . . . . . 0 N--CA 1.48 1.073 0 N-CA-C 109.913 -0.403 . . . . 0.0 109.913 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 90.9 mt -79.52 118.87 21.78 Favored 'General case' 0 N--CA 1.473 0.684 0 C-N-CA 123.396 0.679 . . . . 0.0 109.53 177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.457 ' HB3' ' O ' ' A' ' 8' ' ' GLU . . . -81.74 131.38 35.26 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.219 0.608 . . . . 0.0 111.467 -174.017 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 14.0 m -109.21 38.74 2.22 Favored 'General case' 0 CA--C 1.55 0.952 0 CA-C-O 122.833 1.301 . . . . 0.0 108.176 172.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . 0.44 ' HB3' HD21 ' A' ' 47' ' ' LEU . 1.3 mptm? -67.9 163.6 21.65 Favored 'General case' 0 C--O 1.241 0.619 0 CA-C-N 113.672 -1.604 . . . . 0.0 111.035 174.865 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -116.37 112.81 22.03 Favored 'General case' 0 C--O 1.239 0.533 0 CA-C-N 115.362 -0.835 . . . . 0.0 110.138 178.219 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.542 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.41 168.67 10.25 Favored 'General case' 0 C--O 1.245 0.841 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 169.655 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.445 ' NH2' ' HA3' ' A' ' 1' ' ' GLY . 17.7 ttt180 -150.54 149.3 29.76 Favored 'General case' 0 C--N 1.327 -0.399 0 C-N-CA 122.92 0.488 . . . . 0.0 110.101 -169.525 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.568 HM33 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.243 0.732 0 C-N-CA 124.184 0.994 . . . . 0.0 109.205 176.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.735 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 31.5 m -83.45 79.03 9.55 Favored 'General case' 0 N--CA 1.471 0.622 0 CA-C-O 120.995 0.426 . . . . 0.0 110.566 173.56 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -74.27 119.35 75.97 Favored Pre-proline 0 C--O 1.245 0.849 0 CA-C-N 115.606 -0.725 . . . . 0.0 109.171 172.646 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -58.14 103.28 0.15 Allowed 'Trans proline' 0 C--N 1.375 1.972 0 C-N-CA 122.245 1.964 . . . . 0.0 110.748 172.61 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -74.78 75.51 2.1 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 123.836 0.854 . . . . 0.0 111.222 -173.584 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 7.1 t -91.88 142.86 27.1 Favored 'General case' 0 CA--C 1.543 0.689 0 CA-C-N 114.813 -1.085 . . . . 0.0 109.462 -179.78 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.336 0 CA-C-O 118.808 -0.995 . . . . 0.0 111.824 -179.11 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.959 0 N-CA-C 112.652 -0.179 . . . . 0.0 112.652 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.439 ' HA ' ' O ' ' B' ' 27' ' ' M3L . 4.1 mp0 -101.78 91.03 4.21 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.778 0.831 . . . . 0.0 109.137 -177.647 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.498 ' HB2' ' HD3' ' B' ' 27' ' ' M3L . 1.8 mp0 -82.96 119.16 24.08 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.004 0.521 . . . . 0.0 110.772 -179.554 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.8 t -103.05 127.71 56.64 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.614 0 C-N-CA 124.348 1.059 . . . . 0.0 108.729 175.045 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.456 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 76.1 m-85 -138.87 158.04 44.94 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.368 0.667 . . . . 0.0 109.868 174.206 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.93 101.11 5.06 Favored 'General case' 0 C--O 1.241 0.641 0 N-CA-C 108.569 -0.9 . . . . 0.0 108.569 171.437 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -72.14 139.57 19.49 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 124.186 0.994 . . . . 0.0 110.996 -175.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.413 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 28.4 tt0 -73.11 -51.79 16.67 Favored 'General case' 0 CA--C 1.543 0.701 0 C-N-CA 123.62 0.768 . . . . 0.0 109.907 179.927 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 65.9 p -175.07 -175.84 0.89 Allowed 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 125.054 1.341 . . . . 0.0 109.403 175.628 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.503 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 42.9 mm -97.65 117.65 42.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.737 0 N-CA-C 107.865 -1.161 . . . . 0.0 107.865 169.796 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.5 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.1 tmt_? -74.1 -58.07 3.54 Favored 'General case' 0 CA--C 1.552 1.041 0 C-N-CA 124.5 1.12 . . . . 0.0 109.594 -177.72 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.5 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 68.3 mttm -136.72 178.83 6.77 Favored 'General case' 0 N--CA 1.488 1.448 0 C-N-CA 123.8 0.84 . . . . 0.0 111.011 -176.182 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.443 ' HE3' HG11 ' A' ' 20' ' ' VAL . 86.1 tttt -158.42 147.57 19.17 Favored 'General case' 0 N--CA 1.47 0.544 0 C-N-CA 124.51 1.124 . . . . 0.0 108.917 -175.557 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 15.8 ptm180 -164.03 143.81 8.03 Favored 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.995 0.918 . . . . 0.0 109.369 176.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 13.1 p -88.05 141.65 14.02 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.881 0 N-CA-C 108.563 -0.902 . . . . 0.0 108.563 173.789 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.483 ' HA ' ' HE ' ' A' ' 16' ' ' ARG . 2.3 tpm_? -142.31 99.17 3.45 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.843 0.857 . . . . 0.0 108.747 -174.812 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 66.7 mttm 60.39 29.81 19.31 Favored 'General case' 0 N--CA 1.486 1.365 0 C-N-CA 124.382 1.073 . . . . 0.0 111.487 -176.773 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.82 -17.35 58.85 Favored Glycine 0 CA--C 1.535 1.342 0 CA-C-N 116.264 -0.426 . . . . 0.0 113.417 -175.563 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -88.49 111.59 22.0 Favored 'General case' 0 N--CA 1.482 1.135 0 C-N-CA 123.266 0.626 . . . . 0.0 110.067 177.889 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.443 HG11 ' HE3' ' A' ' 13' ' ' LYS . 50.6 t -85.44 111.39 20.76 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.544 0 CA-C-N 115.563 -0.744 . . . . 0.0 110.006 -175.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.421 ' HB3' ' HB3' ' A' ' 36' ' ' TRP . 34.5 mm-40 -94.17 140.63 29.52 Favored 'General case' 0 C--O 1.236 0.351 0 C-N-CA 125.3 1.44 . . . . 0.0 109.411 -177.37 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 57.5 m-85 -120.12 120.55 36.55 Favored 'General case' 0 N--CA 1.471 0.58 0 N-CA-C 108.189 -1.041 . . . . 0.0 108.189 179.331 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.445 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 43.7 tp -68.82 86.86 0.34 Allowed 'General case' 0 N--CA 1.472 0.641 0 N-CA-C 107.888 -1.153 . . . . 0.0 107.888 172.094 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.513 HG21 HD11 ' A' ' 42' ' ' ILE . 88.4 t -73.18 106.08 2.99 Favored 'Isoleucine or valine' 0 C--O 1.239 0.543 0 CA-C-N 115.221 -0.899 . . . . 0.0 109.187 -175.42 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 28.1 tptp -74.54 100.54 3.91 Favored 'General case' 0 C--N 1.345 0.374 0 N-CA-C 107.534 -1.284 . . . . 0.0 107.534 175.69 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.7 m95 -73.24 145.03 46.48 Favored 'General case' 0 CA--C 1.542 0.657 0 N-CA-C 108.207 -1.034 . . . . 0.0 108.207 174.13 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.413 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 3.8 ttmp? -71.24 -39.82 71.42 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 122.757 0.423 . . . . 0.0 111.836 -173.54 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -85.78 -10.97 74.94 Favored Glycine 0 C--N 1.346 1.112 0 CA-C-N 115.764 -0.653 . . . . 0.0 113.403 -179.613 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.589 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 23.3 m95 -110.24 141.67 24.37 Favored Pre-proline 0 N--CA 1.479 1.016 0 C-N-CA 123.496 0.718 . . . . 0.0 109.468 -176.916 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 71.9 Cg_endo -73.73 163.65 36.72 Favored 'Trans proline' 0 C--N 1.373 1.86 0 C-N-CA 122.414 2.076 . . . . 0.0 111.249 175.484 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 31.8 Cg_exo -57.75 -26.28 72.58 Favored 'Trans proline' 0 C--N 1.386 2.515 0 C-N-CA 123.045 2.497 . . . . 0.0 113.704 -176.472 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -66.34 -38.71 88.27 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.253 0.621 . . . . 0.0 110.881 176.349 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.435 ' HB3' ' HE3' ' A' ' 29' ' ' TRP . 39.6 m-85 -99.05 0.45 43.75 Favored 'General case' 0 N--CA 1.482 1.137 0 C-N-CA 123.463 0.705 . . . . 0.0 111.917 -179.63 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 70.0 m -70.0 129.48 39.57 Favored 'General case' 0 C--N 1.346 0.432 0 N-CA-C 108.184 -1.043 . . . . 0.0 108.184 168.349 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.611 HG21 HM12 ' B' ' 27' ' ' M3L . 26.4 p -109.61 148.94 30.43 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.16 0.584 . . . . 0.0 111.833 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 21' ' ' GLU . 87.5 m95 -77.01 86.81 3.52 Favored 'General case' 0 C--O 1.24 0.559 0 C-N-CA 124.039 0.935 . . . . 0.0 110.402 178.149 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.459 ' HB2' HG21 ' A' ' 24' ' ' VAL . 38.8 mm-40 -97.9 118.44 63.89 Favored Pre-proline 0 C--O 1.241 0.647 0 C-N-CA 123.63 0.772 . . . . 0.0 109.305 177.041 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.42 ' O ' HG12 ' A' ' 42' ' ' ILE . 73.9 Cg_endo -73.65 177.46 7.99 Favored 'Trans proline' 0 C--N 1.369 1.611 0 C-N-CA 122.176 1.917 . . . . 0.0 112.117 176.139 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.3 pt-20 -55.99 -27.2 51.79 Favored 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 124.745 1.218 . . . . 0.0 112.098 175.185 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.93 -28.72 69.73 Favored 'General case' 0 CA--C 1.556 1.192 0 C-N-CA 124.918 1.287 . . . . 0.0 111.914 176.832 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.576 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 12.3 m170 -99.72 -28.76 13.01 Favored 'General case' 0 N--CA 1.48 1.045 0 C-N-CA 124.045 0.938 . . . . 0.0 113.124 -172.803 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.513 HD11 HG21 ' A' ' 24' ' ' VAL . 43.8 mm -79.65 145.75 8.84 Favored 'Isoleucine or valine' 0 N--CA 1.494 1.753 0 C-N-CA 123.948 0.899 . . . . 0.0 112.84 -169.884 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 56.9 mt -78.43 -64.34 1.19 Allowed 'General case' 0 C--N 1.358 0.974 0 C-N-CA 123.946 0.898 . . . . 0.0 110.852 172.448 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.4 t70 -76.93 117.46 65.12 Favored Pre-proline 0 N--CA 1.485 1.313 0 CA-C-O 119.412 -0.327 . . . . 0.0 110.628 -174.025 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 15.0 Cg_exo -69.99 -35.3 12.2 Favored 'Trans proline' 0 C--N 1.378 2.116 0 C-N-CA 123.322 2.682 . . . . 0.0 112.6 178.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 73.0 mtm180 -70.45 -16.9 62.98 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.524 -174.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 30.5 tp -57.64 -44.03 85.33 Favored 'General case' 0 CA--C 1.55 0.966 0 C-N-CA 124.537 1.135 . . . . 0.0 111.342 176.871 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 93.6 t -66.37 -41.94 89.72 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.991 0 C-N-CA 123.543 0.737 . . . . 0.0 110.337 176.611 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 83.2 mtp -63.06 -30.49 71.64 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 115.722 -0.672 . . . . 0.0 111.397 -179.749 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.48 -37.01 85.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.678 0.791 . . . . 0.0 110.869 174.826 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.503 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 92.8 t80 -72.09 -35.04 69.11 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 115.342 -0.845 . . . . 0.0 110.973 176.873 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 30.8 mm-40 -64.03 -29.49 70.64 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.572 0.349 . . . . 0.0 110.589 177.192 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.5 mm-40 -70.37 -28.68 65.3 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.34 0.656 . . . . 0.0 111.679 173.747 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 32.0 mmmt -62.15 -47.94 82.32 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.027 0.531 . . . . 0.0 110.958 179.452 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -91.76 101.81 14.42 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 116.0 -0.546 . . . . 0.0 110.28 179.013 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 . . . . . 0 CA--C 1.558 1.277 0 C-N-CA 124.246 1.018 . . . . 0.0 110.044 179.708 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 46.9 mt-30 . . . . . 0 N--CA 1.494 1.727 0 N-CA-C 111.834 0.309 . . . . 0.0 111.834 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 3.0 mm? -73.57 104.06 4.4 Favored 'General case' 0 C--O 1.244 0.783 0 C-N-CA 123.941 0.896 . . . . 0.0 108.717 174.88 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -74.05 120.45 19.64 Favored 'General case' 0 CA--C 1.54 0.585 0 C-N-CA 122.328 0.251 . . . . 0.0 110.339 177.694 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 24.2 p -84.49 -1.32 55.55 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.287 0.635 . . . . 0.0 110.434 168.513 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 91.7 mttt -57.05 153.8 10.85 Favored 'General case' 0 C--N 1.35 0.604 0 C-N-CA 124.786 1.234 . . . . 0.0 111.839 177.238 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.53 127.9 54.34 Favored 'General case' 0 C--O 1.236 0.369 0 CA-C-N 115.357 -0.838 . . . . 0.0 110.161 -179.412 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -110.78 162.19 15.03 Favored 'General case' 0 C--O 1.242 0.709 0 N-CA-C 108.047 -1.094 . . . . 0.0 108.047 169.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 57.9 ttp180 -142.62 159.86 41.43 Favored 'General case' 0 C--O 1.24 0.556 0 C-N-CA 123.09 0.556 . . . . 0.0 110.025 -172.824 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.611 HM12 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.538 0.491 0 C-N-CA 124.426 1.09 . . . . 0.0 109.705 173.126 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.576 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 17.8 m -57.1 98.42 0.03 OUTLIER 'General case' 0 N--CA 1.488 1.469 0 O-C-N 123.006 0.191 . . . . 0.0 110.554 175.272 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.27 115.43 26.08 Favored Pre-proline 0 CA--C 1.549 0.909 0 C-N-CA 123.16 0.584 . . . . 0.0 110.268 -178.796 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 84.7 Cg_endo -77.41 67.55 7.73 Favored 'Trans proline' 0 C--N 1.379 2.153 0 C-N-CA 122.991 2.461 . . . . 0.0 111.207 179.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -132.8 139.91 47.74 Favored 'General case' 0 N--CA 1.474 0.731 0 C-N-CA 124.384 1.074 . . . . 0.0 110.028 -172.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 35.9 p -79.44 85.98 5.17 Favored 'General case' 0 CA--C 1.546 0.826 0 C-N-CA 123.346 0.658 . . . . 0.0 109.847 177.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.191 0 CA-C-O 119.022 -0.877 . . . . 0.0 112.376 -178.569 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.436 0 N-CA-C 112.33 -0.308 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.2 mt-10 -107.39 -80.94 0.56 Allowed 'General case' 0 C--N 1.351 0.665 0 C-N-CA 123.332 0.653 . . . . 0.0 110.297 177.654 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.5 mm-40 -152.17 157.51 41.61 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 123.562 0.745 . . . . 0.0 111.789 -168.932 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 69.1 t -128.31 129.36 69.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.574 0 C-N-CA 125.378 1.471 . . . . 0.0 107.878 175.287 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.549 ' HE2' HM33 ' B' ' 27' ' ' M3L . 63.7 m-85 -141.7 162.59 35.11 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.367 0.667 . . . . 0.0 110.569 177.397 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -68.98 131.29 44.84 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 115.492 -0.776 . . . . 0.0 109.271 173.859 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.486 HG13 HD11 ' A' ' 47' ' ' LEU . 2.2 p -123.14 133.89 67.78 Favored 'Isoleucine or valine' 0 C--O 1.24 0.594 0 C-N-CA 124.863 1.265 . . . . 0.0 108.55 -174.267 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 6.6 tp10 -80.46 -40.39 26.32 Favored 'General case' 0 CA--C 1.542 0.657 0 CA-C-N 116.326 -0.397 . . . . 0.0 110.706 -176.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 26.3 p -175.91 179.46 1.33 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.788 0.835 . . . . 0.0 110.289 -179.77 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.413 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.9 mm -89.73 122.78 41.47 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.506 0 N-CA-C 107.406 -1.331 . . . . 0.0 107.406 165.483 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.531 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.9 OUTLIER -80.89 -51.2 8.83 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.442 0.697 . . . . 0.0 109.371 -178.27 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.446 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 27.2 mtpp -137.11 171.77 14.0 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.621 0.768 . . . . 0.0 111.104 -175.975 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 85.9 tttt -155.24 143.25 20.04 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.538 0.735 . . . . 0.0 109.953 -174.016 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.3 ptm180 -160.91 144.43 13.25 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.701 0.8 . . . . 0.0 109.614 178.317 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 48.4 t -102.61 115.54 44.71 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 N-CA-C 109.051 -0.722 . . . . 0.0 109.051 177.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 43.5 ttp180 -121.0 119.8 33.57 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 124.347 1.059 . . . . 0.0 109.41 179.169 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 65.9 mttm 63.51 25.65 14.52 Favored 'General case' 0 N--CA 1.492 1.63 0 C-N-CA 124.175 0.99 . . . . 0.0 112.146 177.338 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.0 -12.78 52.43 Favored Glycine 0 N--CA 1.475 1.244 0 CA-C-N 116.227 -0.442 . . . . 0.0 113.053 -174.463 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.476 ' NZ ' ' HB3' ' A' ' 19' ' ' LYS . 1.3 mmmp? -83.67 111.64 19.32 Favored 'General case' 0 C--O 1.237 0.41 0 C-N-CA 124.494 1.118 . . . . 0.0 108.546 178.165 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 25.5 t -82.09 106.23 12.82 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 -177.737 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 7.3 mm-40 -97.3 142.9 28.62 Favored 'General case' 0 CA--C 1.541 0.597 0 C-N-CA 124.459 1.104 . . . . 0.0 109.61 -174.763 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.413 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.6 m-85 -127.25 126.22 42.32 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.601 0.76 . . . . 0.0 109.693 -176.691 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.475 HD23 ' HB3' ' A' ' 11' ' ' ARG . 50.0 tp -67.7 94.17 0.42 Allowed 'General case' 0 C--N 1.349 0.583 0 N-CA-C 108.34 -0.985 . . . . 0.0 108.34 168.343 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.523 HG21 HD11 ' A' ' 42' ' ' ILE . 90.1 t -77.1 104.01 4.73 Favored 'Isoleucine or valine' 0 C--O 1.238 0.481 0 CA-C-N 115.4 -0.818 . . . . 0.0 108.879 -178.326 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.531 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 26.6 tptp -79.97 99.99 7.89 Favored 'General case' 0 C--O 1.24 0.586 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 -177.269 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.6 m95 -67.05 136.43 55.22 Favored 'General case' 0 C--O 1.239 0.535 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 175.981 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 38.2 ttpt -58.7 -33.75 70.53 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.037 0.535 . . . . 0.0 111.024 -178.276 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.54 -55.43 2.71 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.473 -0.785 . . . . 0.0 112.495 176.075 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 98.4 m95 -77.97 129.57 75.55 Favored Pre-proline 0 CA--C 1.563 1.443 0 N-CA-C 112.645 0.609 . . . . 0.0 112.645 -170.567 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.3 Cg_exo -50.49 160.13 1.78 Allowed 'Trans proline' 0 C--N 1.387 2.603 0 C-N-CA 124.673 3.582 . . . . 0.0 113.465 172.742 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.463 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 32.1 Cg_endo -60.55 -17.8 50.67 Favored 'Trans proline' 0 C--N 1.383 2.394 0 C-N-CA 123.132 2.554 . . . . 0.0 114.415 -175.449 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 57.7 pttt -83.13 -32.65 26.56 Favored 'General case' 0 N--CA 1.483 1.211 0 C-N-CA 122.639 0.376 . . . . 0.0 111.214 174.172 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 39.5 m-85 -87.22 -8.67 56.59 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 123.108 0.563 . . . . 0.0 110.578 173.994 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . 0.419 ' HA ' ' CD1' ' A' ' 26' ' ' TRP . 68.0 m -73.44 133.25 43.65 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 108.621 -0.881 . . . . 0.0 108.621 171.503 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 30.8 p -99.44 133.36 43.87 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 123.558 0.743 . . . . 0.0 111.075 -168.759 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.8 m95 -75.02 83.54 2.26 Favored 'General case' 0 N--CA 1.471 0.621 0 C-N-CA 123.263 0.625 . . . . 0.0 110.106 177.247 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.417 ' HB2' HG21 ' A' ' 24' ' ' VAL . 44.4 mm-40 -104.85 130.59 22.91 Favored Pre-proline 0 N--CA 1.468 0.444 0 C-N-CA 123.262 0.625 . . . . 0.0 110.448 -177.569 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.411 ' O ' HG12 ' A' ' 42' ' ' ILE . 40.0 Cg_endo -64.54 164.46 23.55 Favored 'Trans proline' 0 C--N 1.365 1.427 0 C-N-CA 122.003 1.802 . . . . 0.0 112.037 170.644 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -52.86 -30.51 34.21 Favored 'General case' 0 N--CA 1.491 1.585 0 C-N-CA 124.46 1.104 . . . . 0.0 111.701 176.01 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.9 mt-10 -64.9 -34.59 78.77 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 125.212 1.405 . . . . 0.0 111.468 179.804 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 9.0 m170 -85.1 -9.94 57.37 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.961 0.904 . . . . 0.0 112.793 -178.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.523 HD11 HG21 ' A' ' 24' ' ' VAL . 38.8 mm -90.48 155.94 3.05 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.116 0 C-N-CA 123.943 0.897 . . . . 0.0 110.959 -176.596 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 75.4 mt -84.13 -77.67 0.26 Allowed 'General case' 0 C--N 1.353 0.748 0 C-N-CA 123.128 0.571 . . . . 0.0 109.98 167.656 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 23.6 t70 -75.14 127.92 85.72 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-O 119.673 -0.203 . . . . 0.0 111.168 -173.337 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 58.8 Cg_endo -69.26 -31.34 22.96 Favored 'Trans proline' 0 C--N 1.375 1.937 0 C-N-CA 122.547 2.164 . . . . 0.0 113.802 -179.589 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -62.2 -14.42 37.74 Favored 'General case' 0 N--CA 1.492 1.638 0 N-CA-C 113.302 0.853 . . . . 0.0 113.302 -172.66 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.486 HD11 HG13 ' A' ' 7' ' ' VAL . 3.5 mm? -60.3 -50.59 73.03 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 118.749 0.704 . . . . 0.0 110.012 170.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.485 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 74.1 t -67.51 -54.01 27.13 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.53 0 CA-C-N 115.137 -0.938 . . . . 0.0 109.882 178.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.418 ' SD ' ' N ' ' A' ' 49' ' ' MET . 0.4 OUTLIER -58.97 -45.48 90.43 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.746 0.819 . . . . 0.0 112.09 -173.369 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -59.81 -40.12 87.3 Favored 'General case' 0 N--CA 1.485 1.277 0 O-C-N 123.281 0.363 . . . . 0.0 111.175 177.409 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 87.1 t80 -65.45 -37.34 86.6 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 124.061 0.945 . . . . 0.0 110.747 177.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.485 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 31.0 mm-40 -69.95 -23.13 63.14 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.282 0.633 . . . . 0.0 111.081 176.682 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 42.1 mt-10 -96.3 5.79 50.2 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 124.27 1.028 . . . . 0.0 112.227 -179.684 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 73.1 mmtt -78.47 165.55 23.64 Favored 'General case' 0 N--CA 1.485 1.299 0 CA-C-O 120.87 0.367 . . . . 0.0 111.384 179.375 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -61.18 134.1 56.67 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.115 0.966 . . . . 0.0 112.178 -173.237 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 27.3 mm-40 . . . . . 0 C--O 1.248 1.003 0 C-N-CA 123.964 0.906 . . . . 0.0 110.242 -179.598 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 N--CA 1.48 1.042 0 CA-C-O 121.042 0.448 . . . . 0.0 110.002 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 69.8 mt -92.55 159.95 15.26 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.354 1.061 . . . . 0.0 109.268 175.458 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -82.04 153.27 26.24 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.082 0.553 . . . . 0.0 110.398 177.427 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 41.7 p -121.86 5.05 9.94 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.472 0.709 . . . . 0.0 110.452 173.833 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.9 mmmt -82.46 156.89 23.86 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 123.221 0.609 . . . . 0.0 110.756 -171.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -112.77 134.06 54.48 Favored 'General case' 0 C--O 1.239 0.52 0 CA-C-N 115.059 -0.973 . . . . 0.0 109.714 -178.904 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.463 ' HB2' HG11 ' A' ' 7' ' ' VAL . . . -109.19 -175.69 2.83 Favored 'General case' 0 C--O 1.24 0.564 0 N-CA-C 108.823 -0.806 . . . . 0.0 108.823 171.566 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 52.7 ttp180 -150.67 155.69 39.86 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 109.451 -0.574 . . . . 0.0 109.451 -170.36 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.549 HM33 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 N--CA 1.475 0.786 0 C-N-CA 123.689 0.795 . . . . 0.0 112.026 -175.674 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 34.9 p -167.88 157.88 10.3 Favored 'General case' 0 N--CA 1.48 1.048 0 O-C-N 122.053 -0.405 . . . . 0.0 111.416 -168.75 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.82 166.19 34.55 Favored Pre-proline 0 CA--C 1.558 1.268 0 C-N-CA 123.464 0.706 . . . . 0.0 110.863 177.33 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 95.2 Cg_exo -46.11 100.53 0.04 OUTLIER 'Trans proline' 0 C--N 1.387 2.574 0 C-N-CA 123.244 2.629 . . . . 0.0 113.1 173.318 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.43 104.63 4.49 Favored 'General case' 0 C--O 1.242 0.66 0 C-N-CA 124.073 0.949 . . . . 0.0 111.548 -170.938 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 10.3 m -136.1 56.0 1.84 Allowed 'General case' 0 CA--C 1.548 0.89 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 175.696 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.092 0 CA-C-N 114.562 -1.199 . . . . 0.0 110.616 -179.516 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.486 1.967 0 N-CA-C 111.826 -0.51 . . . . 0.0 111.826 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 -68.24 93.0 0.43 Allowed 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 123.271 0.628 . . . . 0.0 111.392 -177.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 57.4 tt0 -78.84 91.54 4.76 Favored 'General case' 0 CA--C 1.541 0.597 0 CA-C-N 115.797 -0.638 . . . . 0.0 109.286 177.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.0 t -102.01 136.1 35.71 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.591 0 CA-C-N 114.958 -1.019 . . . . 0.0 110.012 -175.454 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 73.9 m-85 -138.58 153.85 48.69 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.895 0.878 . . . . 0.0 109.014 170.823 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.66 134.38 47.49 Favored 'General case' 0 C--O 1.244 0.782 0 N-CA-C 108.828 -0.805 . . . . 0.0 108.828 173.734 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.6 p -120.63 141.78 39.46 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.397 0 C-N-CA 124.211 1.005 . . . . 0.0 110.164 -171.402 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 11.1 tp10 -73.65 -60.27 2.33 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.23 -0.896 . . . . 0.0 109.579 174.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.425 ' HB3' HD22 ' B' ' 20' ' ' LEU . 30.3 p -170.91 -174.61 1.58 Allowed 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.425 1.09 . . . . 0.0 109.548 -175.349 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.523 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 50.8 mm -97.87 117.86 43.4 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.546 0 N-CA-C 108.381 -0.97 . . . . 0.0 108.381 173.018 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.24 -50.18 35.56 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 124.048 0.939 . . . . 0.0 110.529 -178.68 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -140.72 170.8 15.09 Favored 'General case' 0 N--CA 1.483 1.191 0 C-N-CA 123.475 0.71 . . . . 0.0 110.634 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.2 tttt -155.77 148.5 24.1 Favored 'General case' 0 N--CA 1.47 0.537 0 C-N-CA 123.894 0.878 . . . . 0.0 108.635 -175.028 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.468 ' NH1' ' HD2' ' A' ' 16' ' ' ARG . 2.2 ptm180 -159.92 154.67 24.32 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.698 -0.683 . . . . 0.0 109.59 -179.67 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 12.5 p -104.44 137.4 33.6 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.542 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 166.596 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.468 ' HD2' ' NH1' ' A' ' 14' ' ' ARG . 75.4 ttt180 -150.52 98.6 2.66 Favored 'General case' 0 N--CA 1.469 0.49 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 -168.869 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 30.1 mmmt 65.55 25.42 11.75 Favored 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 123.549 0.74 . . . . 0.0 111.115 -178.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 91.71 -16.16 59.91 Favored Glycine 0 C--N 1.355 1.595 0 CA-C-N 115.745 -0.661 . . . . 0.0 112.817 -173.892 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 54.7 mttm -84.24 111.32 19.28 Favored 'General case' 0 N--CA 1.474 0.737 0 N-CA-C 108.606 -0.887 . . . . 0.0 108.606 -178.816 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 22.9 t -86.95 108.04 17.6 Favored 'Isoleucine or valine' 0 CA--C 1.534 0.362 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -179.433 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 47.4 mt-10 -97.05 144.43 26.93 Favored 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 123.126 0.57 . . . . 0.0 109.605 -176.917 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.457 ' HB3' HD12 ' A' ' 10' ' ' ILE . 89.3 m-85 -123.45 116.82 23.86 Favored 'General case' 0 C--N 1.331 -0.237 0 N-CA-C 108.013 -1.106 . . . . 0.0 108.013 179.091 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 38.7 tp -68.09 88.02 0.28 Allowed 'General case' 0 N--CA 1.471 0.583 0 N-CA-C 108.089 -1.078 . . . . 0.0 108.089 170.742 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.9 t -69.85 106.98 1.6 Allowed 'Isoleucine or valine' 0 C--O 1.237 0.436 0 CA-C-N 115.098 -0.955 . . . . 0.0 109.938 -175.583 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.2 tptp -76.98 96.97 4.5 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 107.483 -1.303 . . . . 0.0 107.483 172.61 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 67.9 m95 -68.69 145.53 53.78 Favored 'General case' 0 CA--C 1.532 0.254 0 N-CA-C 108.446 -0.946 . . . . 0.0 108.446 177.289 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 36.3 ttmt -80.62 -30.35 36.75 Favored 'General case' 0 CA--C 1.543 0.675 0 N-CA-C 109.766 -0.457 . . . . 0.0 109.766 177.152 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -80.6 -10.65 84.97 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 115.897 -0.592 . . . . 0.0 113.669 177.032 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.563 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 84.3 m95 -131.15 132.36 23.7 Favored Pre-proline 0 CA--C 1.555 1.165 0 C-N-CA 123.474 0.71 . . . . 0.0 110.199 -177.208 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.42 ' HG2' ' HD1' ' A' ' 33' ' ' TYR . 32.4 Cg_endo -62.94 170.11 7.92 Favored 'Trans proline' 0 CA--C 1.572 2.395 0 C-N-CA 122.853 2.369 . . . . 0.0 112.483 175.168 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 37.4 Cg_exo -58.62 -24.2 69.21 Favored 'Trans proline' 0 C--N 1.394 2.947 0 C-N-CA 122.793 2.328 . . . . 0.0 114.016 -174.89 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.0 ptpt -69.86 -28.24 65.5 Favored 'General case' 0 N--CA 1.476 0.859 0 C-N-CA 123.389 0.676 . . . . 0.0 112.512 177.177 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.55 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 80.2 m-85 -96.84 -3.59 41.83 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 123.17 0.588 . . . . 0.0 111.579 175.254 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 55.3 m -66.79 132.86 48.95 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 122.677 0.391 . . . . 0.0 109.988 176.511 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.496 HG21 HM12 ' B' ' 27' ' ' M3L . 30.1 p -122.79 150.37 42.9 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.552 0.741 . . . . 0.0 111.651 -169.878 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -80.55 83.17 6.4 Favored 'General case' 0 N--CA 1.475 0.82 0 C-N-CA 123.622 0.769 . . . . 0.0 110.521 -178.666 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 30.1 mm-40 -95.17 121.22 62.75 Favored Pre-proline 0 CA--C 1.535 0.401 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 178.227 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 61.2 Cg_endo -68.57 165.39 29.45 Favored 'Trans proline' 0 C--N 1.371 1.74 0 C-N-CA 121.853 1.702 . . . . 0.0 111.088 172.591 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.5 pt-20 -53.8 -27.25 28.12 Favored 'General case' 0 N--CA 1.489 1.485 0 C-N-CA 124.078 0.951 . . . . 0.0 112.324 179.841 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.6 mt-10 -60.3 -40.95 92.33 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.796 1.239 . . . . 0.0 110.992 177.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 17.3 m170 -81.45 -29.76 33.68 Favored 'General case' 0 N--CA 1.473 0.722 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.426 -178.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 41.0 mm -68.92 143.95 14.61 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.4 0 C-N-CA 123.473 0.709 . . . . 0.0 111.348 -175.033 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.412 ' HB3' ' O ' ' B' ' 24' ' ' ALA . 5.1 tt -82.69 -77.53 0.23 Allowed 'General case' 0 CA--C 1.546 0.797 0 N-CA-C 108.048 -1.093 . . . . 0.0 108.048 176.146 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -77.65 122.42 85.76 Favored Pre-proline 0 CA--C 1.556 1.186 0 N-CA-C 109.906 -0.405 . . . . 0.0 109.906 -176.496 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.0 Cg_endo -74.33 -15.54 22.48 Favored 'Trans proline' 0 C--N 1.373 1.846 0 C-N-CA 122.779 2.319 . . . . 0.0 114.107 -175.426 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 50.0 mtm180 -71.02 -12.14 61.36 Favored 'General case' 0 N--CA 1.484 1.255 0 N-CA-C 112.704 0.631 . . . . 0.0 112.704 -179.034 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -57.25 -42.11 80.9 Favored 'General case' 0 N--CA 1.487 1.422 0 CA-C-N 118.134 0.425 . . . . 0.0 111.127 170.194 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.508 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 48.0 t -62.12 -50.33 80.46 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.645 0 N-CA-C 109.116 -0.698 . . . . 0.0 109.116 176.122 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.402 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 25.2 mmt -57.48 -40.16 77.97 Favored 'General case' 0 N--CA 1.486 1.359 0 C-N-CA 124.129 0.972 . . . . 0.0 111.66 -177.986 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.549 ' HB1' HD23 ' B' ' 20' ' ' LEU . . . -65.17 -33.76 76.77 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 115.151 -0.931 . . . . 0.0 111.054 179.954 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.523 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 83.1 t80 -74.83 -37.67 62.23 Favored 'General case' 0 CA--C 1.547 0.853 0 C-N-CA 123.429 0.692 . . . . 0.0 110.485 174.927 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.508 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 18.8 mm-40 -67.51 -20.49 65.45 Favored 'General case' 0 N--CA 1.483 1.213 0 C-N-CA 122.792 0.437 . . . . 0.0 110.709 179.383 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 49' ' ' MET . 22.3 mm-40 -66.09 -19.52 65.87 Favored 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 123.699 0.799 . . . . 0.0 112.267 174.805 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.8 OUTLIER -69.61 -19.73 63.63 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 122.872 0.469 . . . . 0.0 110.46 173.688 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 37.4 mt-10 -112.35 176.55 4.97 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 124.478 1.111 . . . . 0.0 109.542 172.597 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 . . . . . 0 C--O 1.251 1.178 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 179.81 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 57.4 tp60 . . . . . 0 N--CA 1.487 1.412 0 N-CA-C 109.904 -0.406 . . . . 0.0 109.904 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . 0.549 HD23 ' HB1' ' A' ' 50' ' ' ALA . 5.0 mp -87.86 154.24 20.69 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.139 0.576 . . . . 0.0 109.989 178.129 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -64.31 112.25 2.99 Favored 'General case' 0 N--CA 1.472 0.653 0 N-CA-C 109.397 -0.594 . . . . 0.0 109.397 173.539 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 11.2 m -69.53 96.32 0.91 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-O 121.554 0.692 . . . . 0.0 110.804 -173.007 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 mmmp? -90.29 -176.48 4.83 Favored 'General case' 0 C--O 1.246 0.896 0 CA-C-N 114.978 -1.01 . . . . 0.0 108.685 172.862 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . 0.412 ' O ' ' HB3' ' A' ' 43' ' ' LEU . . . -121.28 125.46 47.11 Favored 'General case' 0 C--N 1.322 -0.59 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 176.43 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -94.6 -179.25 4.82 Favored 'General case' 0 C--O 1.244 0.794 0 N-CA-C 107.921 -1.141 . . . . 0.0 107.921 169.113 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 56.9 ttp180 -156.11 156.94 35.16 Favored 'General case' 0 C--O 1.239 0.501 0 N-CA-C 109.552 -0.536 . . . . 0.0 109.552 -169.306 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.496 HM12 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 N--CA 1.475 0.778 0 C-N-CA 123.631 0.772 . . . . 0.0 111.123 179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 19.1 m -148.52 150.72 33.89 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 122.347 0.259 . . . . 0.0 111.466 -168.109 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.19 149.35 84.67 Favored Pre-proline 0 CA--C 1.55 0.955 0 C-N-CA 123.199 0.6 . . . . 0.0 110.784 176.449 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 31.2 Cg_endo -63.44 -28.28 70.96 Favored 'Trans proline' 0 C--N 1.376 2.011 0 C-N-CA 122.426 2.084 . . . . 0.0 112.651 175.01 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . 78.17 -45.18 0.41 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.58 1.552 . . . . 0.0 114.379 170.143 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.3 m -65.12 -34.32 78.13 Favored 'General case' 0 N--CA 1.479 1.012 0 C-N-CA 123.365 0.666 . . . . 0.0 111.466 -177.576 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.31 0 CA-C-O 118.667 -1.074 . . . . 0.0 111.565 178.999 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 2.084 0 N-CA-C 112.561 -0.216 . . . . 0.0 112.561 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -84.99 92.28 8.29 Favored 'General case' 0 C--O 1.237 0.415 0 C-N-CA 123.623 0.769 . . . . 0.0 109.464 -179.391 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 48.0 mt-30 -73.53 83.79 1.52 Allowed 'General case' 0 CA--C 1.541 0.605 0 CA-C-N 115.277 -0.874 . . . . 0.0 110.079 -179.962 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 97.8 t -124.99 122.51 63.5 Favored 'Isoleucine or valine' 0 N--CA 1.465 0.294 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 177.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 92.6 m-85 -133.3 160.97 35.76 Favored 'General case' 0 C--O 1.246 0.918 0 C-N-CA 123.31 0.644 . . . . 0.0 109.967 179.234 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.02 136.3 55.06 Favored 'General case' 0 C--O 1.248 1.017 0 N-CA-C 108.219 -1.03 . . . . 0.0 108.219 170.045 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.1 p -116.34 145.27 22.32 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.767 0 C-N-CA 123.82 0.848 . . . . 0.0 110.178 -174.358 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.633 ' HG3' HD12 ' B' ' 20' ' ' LEU . 45.8 tt0 -78.87 -56.17 4.6 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 123.803 0.841 . . . . 0.0 109.748 176.852 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 45.0 p -175.19 -171.53 0.52 Allowed 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.491 1.116 . . . . 0.0 110.2 -177.965 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.547 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.9 mm -99.68 117.97 45.63 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.078 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 170.183 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.1 OUTLIER -73.73 -52.17 14.08 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.509 1.124 . . . . 0.0 110.221 -179.243 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.7 mttm -139.72 169.41 17.78 Favored 'General case' 0 N--CA 1.489 1.501 0 C-N-CA 123.418 0.687 . . . . 0.0 111.353 -178.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.2 tttt -155.77 137.67 14.44 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 124.313 1.045 . . . . 0.0 108.781 -177.15 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 38.7 ptt180 -160.94 137.63 8.7 Favored 'General case' 0 N--CA 1.471 0.62 0 C-N-CA 123.98 0.912 . . . . 0.0 108.935 177.883 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -86.46 129.85 37.63 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 109.237 -0.653 . . . . 0.0 109.237 176.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.0 tmt_? -136.61 113.76 10.64 Favored 'General case' 0 CA--C 1.535 0.398 0 N-CA-C 108.45 -0.944 . . . . 0.0 108.45 -179.146 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 7.8 tmtt? 62.21 33.41 16.77 Favored 'General case' 0 CA--C 1.561 1.382 0 C-N-CA 124.547 1.139 . . . . 0.0 109.459 175.979 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 83.84 -18.94 18.2 Favored Glycine 0 CA--C 1.538 1.5 0 CA-C-N 115.585 -0.734 . . . . 0.0 113.749 -177.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 62.4 mttp -84.54 111.01 19.12 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.51 0.724 . . . . 0.0 109.303 177.866 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 60.9 t -78.59 110.77 14.68 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.54 0 N-CA-C 109.481 -0.562 . . . . 0.0 109.481 -178.662 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.6 mm-40 -93.98 138.76 31.73 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.61 1.164 . . . . 0.0 109.894 -171.329 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.547 ' HB3' HD12 ' A' ' 10' ' ' ILE . 79.1 m-85 -125.54 116.42 21.74 Favored 'General case' 0 N--CA 1.472 0.65 0 C-N-CA 123.432 0.693 . . . . 0.0 109.434 179.716 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 42.8 tp -69.54 91.52 0.59 Allowed 'General case' 0 N--CA 1.469 0.513 0 N-CA-C 108.158 -1.053 . . . . 0.0 108.158 170.149 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.624 HG21 HD11 ' A' ' 42' ' ' ILE . 73.1 t -73.43 106.18 3.24 Favored 'Isoleucine or valine' 0 C--O 1.236 0.395 0 CA-C-N 115.459 -0.791 . . . . 0.0 110.174 -175.789 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.534 ' HE2' ' HD3' ' A' ' 31' ' ' PRO . 25.4 tptp -76.2 102.4 5.78 Favored 'General case' 0 CA--C 1.533 0.323 0 N-CA-C 108.105 -1.072 . . . . 0.0 108.105 174.274 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 87.3 m95 -73.21 154.68 40.16 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.087 0.555 . . . . 0.0 110.894 -179.07 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 63.1 tttp -75.75 -44.28 42.54 Favored 'General case' 0 CA--C 1.54 0.558 0 N-CA-C 108.818 -0.808 . . . . 0.0 108.818 171.159 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -75.48 -41.42 30.12 Favored Glycine 0 C--N 1.352 1.462 0 CA-C-N 115.549 -0.751 . . . . 0.0 113.194 -178.168 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 84.5 m95 -100.91 143.19 26.11 Favored Pre-proline 0 CA--C 1.555 1.137 0 C-N-CA 123.231 0.612 . . . . 0.0 111.166 -175.518 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.4 Cg_endo -72.37 172.86 14.11 Favored 'Trans proline' 0 C--N 1.379 2.183 0 C-N-CA 123.5 2.8 . . . . 0.0 112.415 179.074 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . 0.534 ' HD3' ' HE2' ' A' ' 25' ' ' LYS . 30.0 Cg_endo -61.21 -29.23 86.25 Favored 'Trans proline' 0 C--N 1.394 2.921 0 C-N-CA 122.963 2.442 . . . . 0.0 113.401 -178.366 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 20.3 ptmt -67.5 -30.05 69.63 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.296 0.638 . . . . 0.0 111.401 176.029 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 68.3 m-85 -105.61 13.88 29.27 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.629 0.771 . . . . 0.0 111.614 176.214 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 73.9 m -74.43 136.03 42.35 Favored 'General case' 0 CA--C 1.539 0.549 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 169.637 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.8 p -114.84 138.16 51.1 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 123.492 0.717 . . . . 0.0 112.046 -168.44 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 92.8 m95 -74.88 87.76 2.29 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.542 0.737 . . . . 0.0 109.899 176.432 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.462 ' HB2' HD11 ' A' ' 42' ' ' ILE . 42.9 mm-40 -108.87 116.61 55.48 Favored Pre-proline 0 CA--C 1.534 0.356 0 C-N-CA 123.894 0.878 . . . . 0.0 109.905 178.93 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.405 ' HD2' ' HA ' ' A' ' 37' ' ' GLU . 38.4 Cg_endo -63.25 169.15 9.83 Favored 'Trans proline' 0 C--N 1.37 1.675 0 C-N-CA 122.551 2.167 . . . . 0.0 112.699 169.795 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -52.31 -34.81 48.59 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.306 1.442 . . . . 0.0 113.244 -178.454 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 13.5 tp10 -67.72 -34.37 76.73 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.893 0.877 . . . . 0.0 110.867 178.582 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.3 m-70 -78.78 -17.8 55.19 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 123.625 0.77 . . . . 0.0 111.455 179.215 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.624 HD11 HG21 ' A' ' 24' ' ' VAL . 48.9 mm -98.5 148.78 5.73 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.306 0 C-N-CA 124.359 1.064 . . . . 0.0 110.749 -178.625 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 59.7 mt -82.1 -70.62 0.53 Allowed 'General case' 0 C--N 1.352 0.675 0 C-N-CA 123.49 0.716 . . . . 0.0 109.919 175.301 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -77.01 132.74 70.36 Favored Pre-proline 0 CA--C 1.564 1.484 0 CA-C-N 115.813 -0.63 . . . . 0.0 109.902 -171.759 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.435 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 98.1 Cg_endo -78.48 -30.44 3.2 Favored 'Trans proline' 0 CA--C 1.562 1.913 0 C-N-CA 122.52 2.147 . . . . 0.0 115.0 -176.918 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.435 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.32 0.0 OUTLIER -72.61 -9.7 58.91 Favored 'General case' 0 N--CA 1.504 2.263 0 N-CA-C 113.662 0.986 . . . . 0.0 113.662 -170.031 . . . . . . . . 4 4 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.8 mm? -53.18 -47.91 68.44 Favored 'General case' 0 N--CA 1.501 2.09 0 CA-C-N 119.117 0.871 . . . . 0.0 109.911 166.371 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.422 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 63.0 t -60.87 -45.65 97.76 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.65 0 CA-C-N 114.783 -1.099 . . . . 0.0 110.248 177.463 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.477 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 53.4 mtt -64.09 -30.1 71.19 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.649 0.78 . . . . 0.0 111.305 -177.257 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.08 -34.44 78.42 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.364 0.666 . . . . 0.0 110.115 174.639 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.451 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 46.8 t80 -75.45 -35.12 60.96 Favored 'General case' 0 CA--C 1.552 1.057 0 CA-C-N 115.595 -0.73 . . . . 0.0 110.743 174.389 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.422 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 21.7 mm-40 -69.76 -32.66 71.3 Favored 'General case' 0 N--CA 1.484 1.242 0 C-N-CA 122.583 0.353 . . . . 0.0 111.063 -177.151 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.477 ' HG2' ' O ' ' A' ' 49' ' ' MET . 22.0 mm-40 -89.5 49.78 1.8 Allowed 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.344 0.658 . . . . 0.0 111.179 -178.432 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.451 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 32.0 mmtp -95.88 124.39 39.88 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 122.998 0.519 . . . . 0.0 110.414 173.401 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 6.3 mp0 -94.56 85.03 4.41 Favored 'General case' 0 CA--C 1.542 0.66 0 N-CA-C 107.196 -1.409 . . . . 0.0 107.196 166.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.0 mm-40 . . . . . 0 CA--C 1.559 1.291 0 C-N-CA 125.48 1.512 . . . . 0.0 110.114 -172.173 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 27.5 mt-30 . . . . . 0 N--CA 1.479 0.994 0 CA-C-O 121.62 0.724 . . . . 0.0 109.962 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . 0.633 HD12 ' HG3' ' A' ' 8' ' ' GLU . 1.8 mm? -115.96 132.25 56.7 Favored 'General case' 0 N--CA 1.471 0.577 0 N-CA-C 107.651 -1.241 . . . . 0.0 107.651 177.42 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -75.94 79.23 2.82 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.507 -0.923 . . . . 0.0 108.507 170.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 35.7 p -76.09 69.85 2.71 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.705 1.202 . . . . 0.0 111.055 -172.243 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 25.0 mmmt -116.94 -172.87 2.29 Favored 'General case' 0 C--O 1.251 1.166 0 C-N-CA 124.18 0.992 . . . . 0.0 108.716 -177.516 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -110.08 109.21 19.67 Favored 'General case' 0 C--O 1.234 0.265 0 CA-C-N 115.97 -0.559 . . . . 0.0 109.996 176.815 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.428 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.21 172.15 7.99 Favored 'General case' 0 C--O 1.245 0.834 0 N-CA-C 108.44 -0.948 . . . . 0.0 108.44 167.056 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.463 ' HD2' ' O ' ' B' ' 29' ' ' ALA . 18.7 ttp180 -159.77 152.62 21.59 Favored 'General case' 0 CA--C 1.541 0.602 0 CA-C-N 116.46 -0.336 . . . . 0.0 110.516 -165.282 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.241 0.628 0 C-N-CA 123.763 0.825 . . . . 0.0 110.047 177.163 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 12.5 t 68.62 0.16 2.52 Favored 'General case' 0 N--CA 1.494 1.736 0 N-CA-C 114.093 1.145 . . . . 0.0 114.093 169.271 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.463 ' O ' ' HD2' ' B' ' 26' ' ' ARG . . . -61.89 120.03 53.46 Favored Pre-proline 0 CA--C 1.551 0.99 0 C-N-CA 123.82 0.848 . . . . 0.0 111.877 -170.768 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 32.1 Cg_exo -59.38 -23.39 70.04 Favored 'Trans proline' 0 C--N 1.38 2.227 0 C-N-CA 122.801 2.334 . . . . 0.0 112.401 175.613 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -105.76 173.65 6.22 Favored 'General case' 0 N--CA 1.472 0.652 0 C-N-CA 124.031 0.933 . . . . 0.0 111.32 175.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.0 t -154.21 -16.9 0.13 Allowed 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.629 0.771 . . . . 0.0 111.661 179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.091 0 CA-C-O 118.97 -0.906 . . . . 0.0 112.322 -175.457 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.45 0 N-CA-C 110.822 -0.911 . . . . 0.0 110.822 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.522 ' HA ' ' O ' ' B' ' 27' ' ' M3L . 6.1 mp0 -103.59 68.57 0.94 Allowed 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.47 0.708 . . . . 0.0 110.137 -173.158 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 27.1 mp0 -108.46 142.69 38.47 Favored 'General case' 0 N--CA 1.481 1.102 0 CA-C-O 120.988 0.423 . . . . 0.0 110.403 179.998 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 40.9 t -91.83 132.56 35.92 Favored 'Isoleucine or valine' 0 N--CA 1.468 0.468 0 N-CA-C 108.191 -1.04 . . . . 0.0 108.191 171.988 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.463 ' CE2' HM33 ' B' ' 27' ' ' M3L . 93.8 m-85 -131.93 163.0 29.31 Favored 'General case' 0 N--CA 1.479 1.011 0 N-CA-C 109.066 -0.716 . . . . 0.0 109.066 171.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . 0.423 ' HB3' ' HE3' ' A' ' 27' ' ' LYS . . . -85.57 116.34 23.81 Favored 'General case' 0 C--O 1.242 0.687 0 CA-C-N 115.269 -0.878 . . . . 0.0 109.151 178.595 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.56 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -98.46 141.17 16.72 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 C-N-CA 124.693 1.197 . . . . 0.0 109.28 177.531 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.492 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 9.7 tp10 -80.26 -49.53 11.47 Favored 'General case' 0 N--CA 1.47 0.55 0 N-CA-C 109.737 -0.468 . . . . 0.0 109.737 174.468 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 24.0 p -171.38 171.79 5.41 Favored 'General case' 0 C--O 1.241 0.616 0 CA-C-N 115.242 -0.89 . . . . 0.0 110.142 -176.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.545 ' HB ' ' HB2' ' A' ' 51' ' ' TYR . 49.5 mm -88.27 113.76 25.74 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 CA-C-N 115.411 -0.813 . . . . 0.0 108.865 176.156 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.405 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 1.4 tmt_? -72.06 -53.07 13.98 Favored 'General case' 0 CA--C 1.551 1.013 0 C-N-CA 123.546 0.738 . . . . 0.0 109.415 -178.442 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.455 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 65.6 mttm -137.82 173.89 11.16 Favored 'General case' 0 N--CA 1.488 1.43 0 C-N-CA 123.316 0.646 . . . . 0.0 111.249 -176.717 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 82.5 tttt -157.5 150.38 23.23 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.974 0.91 . . . . 0.0 109.322 -174.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 43.9 ptt85 -168.23 178.75 4.82 Favored 'General case' 0 N--CA 1.473 0.682 0 C-N-CA 124.622 1.169 . . . . 0.0 109.029 173.299 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.1 p -129.43 132.94 66.16 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.893 0 C-N-CA 123.871 0.868 . . . . 0.0 108.747 173.445 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 3.5 tmt_? -142.64 111.76 6.52 Favored 'General case' 0 CA--C 1.545 0.778 0 N-CA-C 108.098 -1.075 . . . . 0.0 108.098 -179.875 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 60.9 mttm 59.91 42.61 16.02 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 124.575 1.15 . . . . 0.0 112.383 179.834 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.89 -17.32 32.24 Favored Glycine 0 N--CA 1.471 0.985 0 CA-C-N 115.8 -0.636 . . . . 0.0 113.516 176.63 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 68.2 mmtt -84.73 109.91 18.39 Favored 'General case' 0 N--CA 1.465 0.322 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 176.564 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 51.1 t -83.92 104.13 11.96 Favored 'Isoleucine or valine' 0 C--O 1.235 0.318 0 N-CA-C 106.79 -1.559 . . . . 0.0 106.79 171.006 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.458 ' HA ' ' HA ' ' A' ' 38' ' ' PRO . 1.0 OUTLIER -103.28 144.74 30.95 Favored 'General case' 0 N--CA 1.476 0.843 0 CA-C-O 121.824 0.821 . . . . 0.0 110.9 -175.758 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -119.11 124.13 46.11 Favored 'General case' 0 C--N 1.331 -0.214 0 CA-C-N 114.019 -1.446 . . . . 0.0 108.355 -173.235 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.455 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 55.1 tp -65.57 89.27 0.1 Allowed 'General case' 0 N--CA 1.473 0.711 0 N-CA-C 108.252 -1.018 . . . . 0.0 108.252 170.503 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.456 HG21 ' HB2' ' A' ' 37' ' ' GLU . 74.1 t -76.01 105.57 5.06 Favored 'Isoleucine or valine' 0 C--O 1.235 0.342 0 CA-C-N 114.812 -1.086 . . . . 0.0 109.173 -176.378 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 26.4 tptp -83.99 99.95 10.74 Favored 'General case' 0 C--O 1.241 0.639 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 -179.475 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 53.0 m95 -66.83 134.58 52.4 Favored 'General case' 0 C--O 1.24 0.601 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 176.589 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.492 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -70.42 -15.96 62.89 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 122.479 0.312 . . . . 0.0 111.651 -177.694 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -114.09 10.11 22.74 Favored Glycine 0 C--N 1.351 1.373 0 CA-C-O 119.666 -0.519 . . . . 0.0 113.664 179.539 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.599 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 81.0 m95 -134.91 148.17 65.86 Favored Pre-proline 0 N--CA 1.498 1.965 0 CA-C-N 117.748 0.774 . . . . 0.0 110.158 178.748 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 87.1 Cg_endo -74.53 165.27 32.05 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.911 2.407 . . . . 0.0 112.062 178.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_exo -51.55 -33.87 49.87 Favored 'Trans proline' 0 C--N 1.391 2.775 0 C-N-CA 124.084 3.189 . . . . 0.0 114.646 -178.135 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 17.7 ptpt -69.43 -30.21 68.1 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.061 0.544 . . . . 0.0 112.357 -179.65 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 58.6 m-85 -95.05 -8.41 36.77 Favored 'General case' 0 N--CA 1.488 1.465 0 C-N-CA 123.609 0.764 . . . . 0.0 111.441 175.083 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 59.4 m -75.35 112.23 11.44 Favored 'General case' 0 CA--C 1.535 0.393 0 N-CA-C 108.299 -1.0 . . . . 0.0 108.299 171.732 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.488 HG21 HM22 ' B' ' 27' ' ' M3L . 20.4 p -98.36 147.79 24.33 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.64 0.776 . . . . 0.0 111.795 -169.601 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 82.3 m95 -75.12 89.02 2.46 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.441 0.696 . . . . 0.0 110.226 177.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.456 ' HB2' HG21 ' A' ' 24' ' ' VAL . 45.8 mm-40 -97.89 119.5 62.16 Favored Pre-proline 0 N--CA 1.469 0.507 0 C-N-CA 123.461 0.704 . . . . 0.0 109.872 178.287 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.458 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 47.4 Cg_endo -66.31 167.49 18.38 Favored 'Trans proline' 0 C--N 1.369 1.636 0 C-N-CA 122.07 1.846 . . . . 0.0 112.001 172.605 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -57.07 -27.0 61.33 Favored 'General case' 0 N--CA 1.493 1.7 0 C-N-CA 124.416 1.087 . . . . 0.0 112.262 176.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 38.8 tt0 -55.42 -35.33 65.28 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 125.176 1.39 . . . . 0.0 111.717 171.907 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.689 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 16.6 m170 -93.44 -18.15 22.66 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.075 0.95 . . . . 0.0 112.559 -173.92 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.429 HG12 ' O ' ' A' ' 38' ' ' PRO . 30.1 mm -86.54 151.57 3.6 Favored 'Isoleucine or valine' 0 N--CA 1.497 1.911 0 C-N-CA 124.061 0.944 . . . . 0.0 111.352 -171.793 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.0 mt -96.73 -69.15 0.77 Allowed 'General case' 0 N--CA 1.486 1.37 0 C-N-CA 123.749 0.82 . . . . 0.0 110.823 179.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.1 t70 -70.15 117.34 53.38 Favored Pre-proline 0 CA--C 1.554 1.114 0 N-CA-C 107.998 -1.112 . . . . 0.0 107.998 176.698 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.42 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 72.0 Cg_endo -74.37 -17.83 20.93 Favored 'Trans proline' 0 C--N 1.369 1.646 0 C-N-CA 122.722 2.281 . . . . 0.0 113.185 -175.939 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.42 ' HD3' ' HG2' ' A' ' 45' ' ' PRO . 0.0 OUTLIER -72.22 -12.22 61.07 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 123.502 0.721 . . . . 0.0 112.481 -177.652 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.405 HD11 HG13 ' A' ' 7' ' ' VAL . 2.2 mm? -52.13 -51.06 60.22 Favored 'General case' 0 N--CA 1.502 2.137 0 CA-C-N 118.512 0.597 . . . . 0.0 110.59 169.479 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.489 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 59.3 t -61.04 -48.4 89.24 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.762 0 O-C-N 124.107 0.879 . . . . 0.0 109.694 178.992 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 22.2 mmt -60.44 -38.49 84.31 Favored 'General case' 0 N--CA 1.486 1.352 0 CA-C-N 115.067 -0.969 . . . . 0.0 111.998 -175.118 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.84 -36.41 83.39 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.754 0.821 . . . . 0.0 110.571 179.252 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.545 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 81.5 t80 -69.8 -42.72 73.36 Favored 'General case' 0 CA--C 1.547 0.858 0 C-N-CA 123.723 0.809 . . . . 0.0 110.424 176.245 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.489 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 32.3 mm-40 -60.69 -37.88 83.14 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.263 0.625 . . . . 0.0 111.285 -177.288 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 29.1 mm-40 -65.96 -38.76 89.42 Favored 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 123.884 0.873 . . . . 0.0 112.218 -179.482 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -92.29 128.28 38.08 Favored 'General case' 0 CA--C 1.546 0.804 0 CA-C-O 121.273 0.558 . . . . 0.0 110.724 -176.17 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -143.79 92.0 2.3 Favored 'General case' 0 CA--C 1.542 0.639 0 N-CA-C 106.838 -1.542 . . . . 0.0 106.838 173.004 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.8 pt-20 . . . . . 0 CA--C 1.555 1.144 0 C-N-CA 123.62 0.768 . . . . 0.0 110.946 -171.572 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 1.5 mp0 . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 109.222 -0.658 . . . . 0.0 109.222 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 93.4 mt -75.92 105.28 6.87 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 122.905 0.482 . . . . 0.0 109.707 179.026 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -99.15 33.07 2.49 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 124.269 1.028 . . . . 0.0 109.83 178.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . 0.421 ' HA ' ' O ' ' A' ' 7' ' ' VAL . 34.3 m -61.6 106.92 0.72 Allowed 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 123.906 0.882 . . . . 0.0 111.04 -177.836 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 71.8 mttt -126.79 -173.19 2.82 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 125.518 1.527 . . . . 0.0 109.492 -175.001 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -107.06 106.64 17.25 Favored 'General case' 0 CA--C 1.528 0.123 0 CA-C-O 121.097 0.475 . . . . 0.0 110.761 -177.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -106.75 151.05 25.66 Favored 'General case' 0 C--O 1.242 0.667 0 N-CA-C 107.038 -1.468 . . . . 0.0 107.038 162.254 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 75.7 ttt180 -134.52 158.95 42.65 Favored 'General case' 0 C--N 1.316 -0.875 0 N-CA-C 108.728 -0.842 . . . . 0.0 108.728 -175.098 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.522 ' O ' ' HA ' ' A' ' 2' ' ' GLU . . . . . . . . 0 N--CA 1.447 -0.575 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 171.932 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.689 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 15.2 m -67.74 77.04 0.2 Allowed 'General case' 0 N--CA 1.488 1.452 0 CA-C-O 121.125 0.488 . . . . 0.0 109.983 178.19 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -75.68 123.05 88.24 Favored Pre-proline 0 C--O 1.24 0.59 0 N-CA-C 108.796 -0.816 . . . . 0.0 108.796 -175.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_exo -56.18 150.96 45.81 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.093 2.529 . . . . 0.0 112.825 -177.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.77 -34.09 75.25 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.775 0.83 . . . . 0.0 110.789 -179.142 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 14.1 t -157.85 166.39 32.8 Favored 'General case' 0 CA--C 1.543 0.703 0 C-N-CA 124.535 1.134 . . . . 0.0 109.381 175.429 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.122 0 N-CA-C 110.637 -0.985 . . . . 0.0 110.637 -176.83 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.416 0 N-CA-C 112.023 -0.431 . . . . 0.0 112.023 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.437 ' HA ' ' O ' ' B' ' 27' ' ' M3L . 39.6 mt-10 -78.5 102.87 8.08 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.474 0.709 . . . . 0.0 109.664 176.52 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.626 ' HB2' ' HD3' ' B' ' 27' ' ' M3L . 15.0 mm100 -92.87 110.93 22.4 Favored 'General case' 0 CA--C 1.542 0.648 0 C-N-CA 123.241 0.616 . . . . 0.0 110.846 -174.689 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 91.4 t -103.24 116.19 46.54 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 123.565 0.746 . . . . 0.0 109.108 176.482 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 97.5 m-85 -130.34 167.03 19.18 Favored 'General case' 0 C--O 1.245 0.851 0 C-N-CA 123.718 0.807 . . . . 0.0 109.402 175.134 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -71.13 122.06 19.44 Favored 'General case' 0 C--O 1.242 0.703 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.035 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 3.2 p -97.97 135.94 30.68 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.619 0 C-N-CA 123.356 0.662 . . . . 0.0 110.177 -176.86 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -68.19 -52.72 31.19 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.951 0.901 . . . . 0.0 110.007 179.433 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 21.2 p -177.72 178.0 1.05 Allowed 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 114.418 -1.264 . . . . 0.0 109.714 -176.831 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.464 HD12 ' HB3' ' A' ' 22' ' ' TYR . 47.9 mm -89.95 114.99 28.62 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.38 -1.341 . . . . 0.0 107.38 168.956 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.558 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -69.82 -51.4 33.89 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.643 0.777 . . . . 0.0 109.05 -179.393 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 63.5 mttm -139.26 161.82 36.49 Favored 'General case' 0 N--CA 1.487 1.382 0 C-N-CA 123.301 0.641 . . . . 0.0 111.348 179.133 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . 0.528 ' HE3' HG11 ' A' ' 20' ' ' VAL . 83.1 tttt -147.69 133.35 18.85 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.53 1.132 . . . . 0.0 108.064 -179.608 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -159.29 139.39 11.97 Favored 'General case' 0 C--O 1.222 -0.343 0 C-N-CA 123.476 0.71 . . . . 0.0 109.396 -179.286 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.469 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 5.0 p -87.22 121.41 37.88 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.722 0 N-CA-C 109.273 -0.64 . . . . 0.0 109.273 175.388 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.2 tpt180 -134.46 123.49 24.07 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 123.74 0.816 . . . . 0.0 109.045 -176.558 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm 64.24 28.02 13.9 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.324 1.05 . . . . 0.0 111.854 -177.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 88.83 -16.97 53.31 Favored Glycine 0 C--N 1.351 1.406 0 CA-C-N 115.484 -0.78 . . . . 0.0 113.258 179.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.8 mtmt -105.46 134.3 48.8 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.82 0.848 . . . . 0.0 110.443 -176.631 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.528 HG11 ' HE3' ' A' ' 13' ' ' LYS . 21.7 t -83.2 116.36 27.2 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.741 0 CA-C-O 120.817 0.342 . . . . 0.0 110.934 -174.527 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 8.3 mm-40 -95.36 142.03 28.23 Favored 'General case' 0 C--O 1.242 0.701 0 C-N-CA 124.895 1.278 . . . . 0.0 109.741 -178.066 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.464 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.1 m-85 -125.0 120.44 31.56 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.49 0.716 . . . . 0.0 109.75 -178.706 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.512 HD23 ' HD2' ' A' ' 11' ' ' ARG . 27.7 tp -75.22 82.32 2.37 Favored 'General case' 0 CA--C 1.533 0.305 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 169.787 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.469 HG21 HD11 ' A' ' 42' ' ' ILE . 67.1 t -68.65 106.49 1.15 Allowed 'Isoleucine or valine' 0 CA--C 1.535 0.39 0 CA-C-N 114.777 -1.101 . . . . 0.0 110.421 -175.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.558 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.3 tptp -84.53 102.82 13.15 Favored 'General case' 0 C--O 1.235 0.313 0 N-CA-C 108.762 -0.829 . . . . 0.0 108.762 176.552 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.597 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 72.8 m95 -71.5 147.05 48.14 Favored 'General case' 0 CA--C 1.536 0.43 0 CA-C-N 115.884 -0.598 . . . . 0.0 110.247 178.885 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 29.8 ttpt -78.44 -36.14 45.87 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.157 0.583 . . . . 0.0 109.903 179.508 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -78.43 -14.45 82.16 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.755 -0.657 . . . . 0.0 113.775 178.595 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.597 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 93.4 m95 -120.3 148.92 48.51 Favored Pre-proline 0 CA--C 1.553 1.09 0 C-N-CA 123.253 0.621 . . . . 0.0 111.381 -175.65 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -72.65 169.97 20.62 Favored 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.22 2.613 . . . . 0.0 112.2 175.104 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 54.2 Cg_exo -55.52 -26.43 54.45 Favored 'Trans proline' 0 C--N 1.393 2.893 0 C-N-CA 123.715 2.943 . . . . 0.0 114.999 179.796 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 21.7 ptmt -70.41 -9.23 55.8 Favored 'General case' 0 N--CA 1.484 1.245 0 N-CA-C 112.177 0.436 . . . . 0.0 112.177 177.608 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.423 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 69.5 m-85 -118.02 14.25 14.06 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.869 0.867 . . . . 0.0 111.409 175.398 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.1 p -70.07 116.8 10.86 Favored 'General case' 0 CA--C 1.542 0.659 0 N-CA-C 107.801 -1.185 . . . . 0.0 107.801 169.991 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.0 p -105.36 137.19 43.56 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.297 0.639 . . . . 0.0 111.878 -168.793 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -73.87 83.43 1.68 Allowed 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.111 0.564 . . . . 0.0 109.933 174.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 33.2 mm-40 -110.62 113.14 55.96 Favored Pre-proline 0 C--O 1.237 0.419 0 C-N-CA 123.892 0.877 . . . . 0.0 108.863 176.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.429 ' HA ' ' HD2' ' A' ' 22' ' ' TYR . 61.9 Cg_endo -66.8 166.84 21.1 Favored 'Trans proline' 0 C--N 1.365 1.424 0 C-N-CA 122.238 1.959 . . . . 0.0 111.782 173.833 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.7 pt-20 -57.21 -23.87 50.75 Favored 'General case' 0 N--CA 1.494 1.759 0 C-N-CA 124.582 1.153 . . . . 0.0 112.807 -177.827 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 26.4 mt-10 -62.46 -27.25 68.99 Favored 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.106 1.362 . . . . 0.0 111.655 178.246 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.427 ' NE2' ' HA ' ' B' ' 30' ' ' PRO . 11.4 m-70 -113.01 2.84 15.9 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.398 1.079 . . . . 0.0 112.408 -173.243 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.568 HD12 ' HB1' ' B' ' 25' ' ' ALA . 48.8 mm -101.16 148.55 7.04 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.396 0 C-N-CA 124.58 1.152 . . . . 0.0 110.793 -178.581 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.629 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 53.5 mt -75.68 -78.93 0.1 Allowed 'General case' 0 C--N 1.359 0.992 0 C-N-CA 122.989 0.515 . . . . 0.0 110.811 172.458 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 9.5 t70 -75.05 112.85 19.92 Favored Pre-proline 0 N--CA 1.48 1.07 0 N-CA-C 109.102 -0.703 . . . . 0.0 109.102 -174.0 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 87.5 Cg_endo -78.21 -13.65 15.29 Favored 'Trans proline' 0 C--N 1.371 1.752 0 C-N-CA 122.872 2.382 . . . . 0.0 112.945 -177.459 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.56 -12.38 61.34 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.469 0.708 . . . . 0.0 111.41 179.111 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.591 HD22 ' NZ ' ' B' ' 23' ' ' LYS . 3.1 mm? -51.05 -39.16 55.31 Favored 'General case' 0 N--CA 1.488 1.462 0 C-N-CA 122.478 0.311 . . . . 0.0 110.87 167.521 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 44.5 t -68.5 -51.48 46.24 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.626 0 C-N-CA 123.861 0.864 . . . . 0.0 110.882 -176.902 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.44 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 28.3 ptm -64.08 -35.08 79.57 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 116.065 -0.516 . . . . 0.0 111.0 -178.674 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -63.11 -34.03 76.73 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 123.672 0.789 . . . . 0.0 111.315 178.769 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.443 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 74.3 t80 -70.14 -35.36 74.01 Favored 'General case' 0 CA--C 1.548 0.878 0 CA-C-N 115.095 -0.957 . . . . 0.0 110.458 174.535 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 44.8 mt-10 -85.14 -7.44 59.07 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.5 0.72 . . . . 0.0 111.965 -178.605 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.44 ' HG2' ' O ' ' A' ' 49' ' ' MET . 43.8 mm-40 -72.63 -13.59 61.41 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 122.71 0.404 . . . . 0.0 109.978 166.67 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -87.1 165.66 15.6 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 122.991 0.516 . . . . 0.0 109.802 174.214 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 26.0 mt-10 -88.48 116.19 26.53 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 123.868 0.867 . . . . 0.0 111.286 -172.619 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 . . . . . 0 C--O 1.252 1.227 0 C-N-CA 123.664 0.785 . . . . 0.0 109.755 175.64 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 77.7 mt-30 . . . . . 0 N--CA 1.481 1.098 0 N-CA-C 109.503 -0.554 . . . . 0.0 109.503 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 55.7 tp -136.49 122.29 19.91 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.783 0.833 . . . . 0.0 108.942 179.55 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -85.76 107.13 17.48 Favored 'General case' 0 CA--C 1.54 0.588 0 C-N-CA 123.159 0.584 . . . . 0.0 110.568 -177.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 42.1 p -91.07 43.04 1.13 Allowed 'General case' 0 N--CA 1.481 1.085 0 CA-C-O 122.634 1.207 . . . . 0.0 108.629 168.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . 0.591 ' NZ ' HD22 ' A' ' 47' ' ' LEU . 6.8 mtpm? -123.57 146.69 47.95 Favored 'General case' 0 C--O 1.241 0.635 0 C-N-CA 126.503 1.921 . . . . 0.0 107.321 -168.407 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -117.96 137.93 52.51 Favored 'General case' 0 N--CA 1.472 0.639 0 CA-C-O 121.107 0.479 . . . . 0.0 111.041 -174.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.568 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -102.9 -167.65 1.42 Allowed 'General case' 0 CA--C 1.543 0.677 0 CA-C-N 114.96 -1.018 . . . . 0.0 108.41 171.975 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.629 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 75.9 ttt180 -156.39 143.61 19.02 Favored 'General case' 0 N--CA 1.473 0.716 0 N-CA-C 109.735 -0.468 . . . . 0.0 109.735 -172.582 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.626 ' HD3' ' HB2' ' A' ' 3' ' ' GLN . . . . . . . . 0 C--O 1.242 0.678 0 C-N-CA 123.287 0.635 . . . . 0.0 109.742 173.312 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.419 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 17.2 m -69.82 139.26 53.14 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 108.892 -0.781 . . . . 0.0 108.892 170.469 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.17 154.49 30.48 Favored Pre-proline 0 N--CA 1.479 0.986 0 C-N-CA 122.95 0.5 . . . . 0.0 111.107 177.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . 0.427 ' HA ' ' NE2' ' A' ' 41' ' ' HIS . 73.0 Cg_exo -52.54 -26.8 30.12 Favored 'Trans proline' 0 C--N 1.376 1.981 0 C-N-CA 122.963 2.442 . . . . 0.0 114.187 177.932 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -107.01 29.2 7.29 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 124.073 0.949 . . . . 0.0 111.051 177.364 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 21.0 m -145.1 136.92 25.57 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.517 0.727 . . . . 0.0 109.737 -178.699 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.186 0 CA-C-O 118.936 -0.924 . . . . 0.0 112.332 176.537 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.546 0 N-CA-C 111.858 -0.497 . . . . 0.0 111.858 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.73 ' HG2' ' H ' ' B' ' 29' ' ' ALA . 37.9 mt-10 -78.76 88.86 4.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.557 0.743 . . . . 0.0 110.349 178.773 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -99.39 111.16 23.57 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.334 1.054 . . . . 0.0 110.778 -171.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.403 HG22 ' HD3' ' B' ' 26' ' ' ARG . 20.0 t -88.3 127.19 41.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.464 0.706 . . . . 0.0 109.635 179.992 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.427 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 87.7 m-85 -140.58 152.76 45.74 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.291 0.636 . . . . 0.0 110.113 172.659 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -70.28 117.37 11.75 Favored 'General case' 0 C--O 1.239 0.51 0 N-CA-C 108.17 -1.048 . . . . 0.0 108.17 170.074 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -91.39 134.19 30.65 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.618 0 C-N-CA 123.432 0.693 . . . . 0.0 110.104 -177.625 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.533 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 43.8 tt0 -68.04 -43.68 78.16 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 123.424 0.69 . . . . 0.0 110.505 178.232 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 11.8 p 177.94 169.51 0.72 Allowed 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.386 1.074 . . . . 0.0 110.399 179.519 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.48 HG23 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -82.19 113.19 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 170.267 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.496 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 0.1 OUTLIER -73.02 -58.12 3.54 Favored 'General case' 0 CA--C 1.544 0.722 0 N-CA-C 108.793 -0.818 . . . . 0.0 108.793 -177.378 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.422 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 98.3 mttt -134.31 174.29 10.68 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.723 0.809 . . . . 0.0 109.789 -178.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 48.0 tttm -159.85 141.59 12.95 Favored 'General case' 0 C--O 1.237 0.446 0 C-N-CA 123.756 0.822 . . . . 0.0 109.075 -174.06 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.3 ptm180 -154.12 159.46 41.48 Favored 'General case' 0 N--CA 1.469 0.499 0 C-N-CA 123.521 0.728 . . . . 0.0 109.755 -174.22 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 20' ' ' VAL . 40.8 t -104.13 130.25 55.1 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.486 0 N-CA-C 107.273 -1.38 . . . . 0.0 107.273 168.779 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 4.8 tmm_? -146.73 111.53 5.31 Favored 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 108.16 -1.052 . . . . 0.0 108.16 179.228 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 48.3 tptt 65.43 26.35 11.91 Favored 'General case' 0 CA--C 1.562 1.425 0 C-N-CA 124.809 1.243 . . . . 0.0 110.324 -174.777 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 79.83 -9.21 46.0 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-N 115.228 -0.896 . . . . 0.0 113.156 -174.279 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.7 mmmm -88.06 110.55 20.71 Favored 'General case' 0 C--O 1.237 0.441 0 N-CA-C 107.817 -1.179 . . . . 0.0 107.817 179.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.4 HG22 HG22 ' A' ' 15' ' ' VAL . 47.9 t -84.1 107.07 15.03 Favored 'Isoleucine or valine' 0 C--O 1.238 0.497 0 N-CA-C 109.234 -0.654 . . . . 0.0 109.234 -174.437 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.6 mt-10 -98.49 141.42 31.37 Favored 'General case' 0 N--CA 1.467 0.399 0 C-N-CA 123.784 0.834 . . . . 0.0 110.477 -173.022 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.48 ' HB3' HG23 ' A' ' 10' ' ' ILE . 8.6 m-85 -114.23 125.01 53.43 Favored 'General case' 0 N--CA 1.465 0.321 0 N-CA-C 108.246 -1.02 . . . . 0.0 108.246 -178.808 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.422 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 31.9 tp -70.86 85.17 0.67 Allowed 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 107.568 -1.271 . . . . 0.0 107.568 169.669 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.408 HG21 ' HB2' ' A' ' 37' ' ' GLU . 95.3 t -72.78 104.13 1.92 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.497 0 CA-C-N 115.158 -0.928 . . . . 0.0 109.454 -173.215 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.496 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.8 tptp -84.0 100.34 11.0 Favored 'General case' 0 C--N 1.345 0.388 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 -179.35 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.547 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 44.1 m95 -69.35 151.03 46.67 Favored 'General case' 0 CA--C 1.538 0.488 0 CA-C-N 114.767 -1.106 . . . . 0.0 109.623 -179.717 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.533 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 35.7 ttpt -67.88 -46.11 72.6 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 122.981 0.512 . . . . 0.0 111.419 -173.795 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.87 -6.15 72.81 Favored Glycine 0 C--N 1.35 1.34 0 CA-C-N 115.878 -0.601 . . . . 0.0 113.868 -176.877 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.547 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 56.3 m95 -114.85 129.49 24.97 Favored Pre-proline 0 CA--C 1.552 1.052 0 C-N-CA 123.404 0.682 . . . . 0.0 110.148 -175.124 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 29.3 Cg_endo -61.57 165.35 13.64 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.155 2.57 . . . . 0.0 112.35 171.925 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 46.9 Cg_endo -64.41 -8.95 18.38 Favored 'Trans proline' 0 C--N 1.388 2.606 0 C-N-CA 123.378 2.718 . . . . 0.0 114.709 -175.506 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -73.58 -26.84 61.0 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 122.464 0.306 . . . . 0.0 110.998 173.531 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 48.9 m-85 -99.45 -12.41 20.24 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.813 0.845 . . . . 0.0 111.52 178.38 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 89.7 p -64.65 119.8 11.21 Favored 'General case' 0 N--CA 1.478 0.943 0 N-CA-C 108.869 -0.789 . . . . 0.0 108.869 176.849 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 22.7 p -107.06 150.27 26.71 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 123.787 0.835 . . . . 0.0 111.113 -172.333 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 95.7 m95 -76.41 86.63 3.16 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.46 0.704 . . . . 0.0 110.194 178.017 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.408 ' HB2' HG21 ' A' ' 24' ' ' VAL . 47.2 mm-40 -98.17 110.19 55.1 Favored Pre-proline 0 CA--C 1.54 0.58 0 C-N-CA 123.607 0.763 . . . . 0.0 109.356 175.539 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.479 ' O ' HG12 ' A' ' 42' ' ' ILE . 61.7 Cg_endo -68.99 176.43 6.2 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.257 1.972 . . . . 0.0 112.114 172.646 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.9 pt-20 -60.08 -23.22 63.61 Favored 'General case' 0 N--CA 1.493 1.717 0 C-N-CA 123.501 0.72 . . . . 0.0 112.354 -179.674 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -58.45 -38.85 78.35 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 124.223 1.009 . . . . 0.0 110.975 172.077 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.746 ' HA ' ' HB2' ' B' ' 28' ' ' SER . 42.6 m170 -94.18 -15.7 24.36 Favored 'General case' 0 CA--C 1.545 0.786 0 C-N-CA 124.346 1.058 . . . . 0.0 112.457 -173.734 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.479 HG12 ' O ' ' A' ' 38' ' ' PRO . 46.6 mm -83.69 147.15 5.98 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.401 0 C-N-CA 123.567 0.747 . . . . 0.0 112.121 -173.439 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 96.3 mt -88.2 -70.47 0.63 Allowed 'General case' 0 C--N 1.36 1.031 0 C-N-CA 123.827 0.851 . . . . 0.0 109.896 172.96 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -77.42 115.97 53.88 Favored Pre-proline 0 CA--C 1.55 0.956 0 N-CA-C 109.997 -0.372 . . . . 0.0 109.997 -176.094 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_endo -74.3 -18.95 20.18 Favored 'Trans proline' 0 C--N 1.37 1.676 0 C-N-CA 122.713 2.275 . . . . 0.0 112.955 -174.6 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.455 ' HA ' ' SD ' ' A' ' 49' ' ' MET . 75.2 mtm180 -73.99 -15.04 61.11 Favored 'General case' 0 N--CA 1.478 0.969 0 C-N-CA 123.718 0.807 . . . . 0.0 111.974 -176.787 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 69.9 mt -53.43 -52.55 59.04 Favored 'General case' 0 N--CA 1.484 1.262 0 C-N-CA 124.029 0.932 . . . . 0.0 112.13 178.053 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 2.9 p -66.66 -34.97 73.54 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.879 0 CA-C-N 115.556 -0.747 . . . . 0.0 111.238 178.649 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.455 ' SD ' ' HA ' ' A' ' 46' ' ' ARG . 57.5 mtt -59.97 -43.27 95.2 Favored 'General case' 0 N--CA 1.485 1.32 0 C-N-CA 123.49 0.716 . . . . 0.0 111.017 -178.765 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.66 -35.62 78.48 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.389 0.676 . . . . 0.0 111.412 176.783 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 64.1 t80 -73.93 -32.94 63.75 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-N 115.758 -0.655 . . . . 0.0 110.618 178.511 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 11.2 mm-40 -75.38 -20.49 58.94 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.585 0.754 . . . . 0.0 112.118 -178.027 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 19.3 mm-40 -68.6 -21.19 64.52 Favored 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 123.081 0.552 . . . . 0.0 111.267 173.216 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 20.6 ptmt -123.51 -174.68 3.02 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 124.332 1.053 . . . . 0.0 109.48 175.263 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 16.5 mm-40 59.84 15.17 4.67 Favored 'General case' 0 N--CA 1.49 1.535 0 C-N-CA 124.978 1.311 . . . . 0.0 112.964 174.305 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.8 pt-20 . . . . . 0 CA--C 1.558 1.256 0 C-N-CA 124.098 0.959 . . . . 0.0 110.381 -176.012 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 52.4 mt-30 . . . . . 0 N--CA 1.476 0.857 0 CA-C-O 121.321 0.581 . . . . 0.0 109.96 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 5.3 mp -95.39 140.01 30.88 Favored 'General case' 0 N--CA 1.478 0.952 0 N-CA-C 108.4 -0.963 . . . . 0.0 108.4 175.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -101.63 134.54 44.61 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 123.486 0.715 . . . . 0.0 110.37 -173.651 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 81.6 p -89.78 3.27 53.36 Favored 'General case' 0 CA--C 1.551 1.008 0 C-N-CA 124.274 1.03 . . . . 0.0 110.128 171.088 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.0 mtpt -82.05 144.24 30.97 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 125.536 1.534 . . . . 0.0 109.886 -175.58 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -96.03 137.96 34.35 Favored 'General case' 0 N--CA 1.474 0.737 0 C-N-CA 123.063 0.545 . . . . 0.0 110.557 -178.886 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.99 167.52 12.08 Favored 'General case' 0 C--O 1.242 0.67 0 N-CA-C 107.97 -1.122 . . . . 0.0 107.97 169.884 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.407 ' HD2' ' HB3' ' A' ' 2' ' ' GLU . 60.1 ttp180 -144.45 160.73 40.59 Favored 'General case' 0 N--CA 1.469 0.499 0 CA-C-O 121.355 0.598 . . . . 0.0 109.565 -178.714 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.449 ' O ' ' HA ' ' A' ' 2' ' ' GLU . . . . . . . . 0 C--N 1.327 -0.392 0 CA-C-N 115.219 -0.9 . . . . 0.0 108.714 167.668 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.746 ' HB2' ' HA ' ' A' ' 41' ' ' HIS . 15.9 m -62.41 96.05 0.07 Allowed 'General case' 0 C--N 1.363 1.18 0 CA-C-N 116.327 -0.397 . . . . 0.0 110.379 -179.854 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.73 ' H ' ' HG2' ' A' ' 2' ' ' GLU . . . -61.57 123.79 78.29 Favored Pre-proline 0 CA--C 1.551 0.994 0 C-N-CA 124.483 1.113 . . . . 0.0 111.412 -178.316 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . 0.421 ' HD3' ' HA ' ' B' ' 29' ' ' ALA . 23.5 Cg_exo -65.77 166.73 19.33 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 123.152 2.568 . . . . 0.0 112.884 179.4 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -82.06 147.19 29.26 Favored 'General case' 0 C--O 1.242 0.675 0 C-N-CA 123.382 0.673 . . . . 0.0 109.414 173.246 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 9.3 t -161.71 171.67 17.51 Favored 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 122.934 0.494 . . . . 0.0 110.715 -176.1 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.165 0 CA-C-O 118.826 -0.986 . . . . 0.0 110.768 175.869 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.633 0 N-CA-C 111.949 -0.461 . . . . 0.0 111.949 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.487 ' HA ' ' HB1' ' B' ' 29' ' ' ALA . 8.5 pt-20 -89.17 167.89 12.74 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.346 0.658 . . . . 0.0 110.83 179.022 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 5.8 tp-100 -137.11 100.68 4.34 Favored 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 122.902 0.481 . . . . 0.0 109.868 177.747 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 45.3 t -128.38 134.24 65.18 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.07 0 C-N-CA 124.342 1.057 . . . . 0.0 109.276 179.53 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.664 ' HE2' HM13 ' B' ' 27' ' ' M3L . 61.8 m-85 -132.52 159.02 40.62 Favored 'General case' 0 C--O 1.249 1.046 0 C-N-CA 123.227 0.611 . . . . 0.0 109.633 172.365 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.03 124.97 24.54 Favored 'General case' 0 C--O 1.249 1.064 0 N-CA-C 108.201 -1.037 . . . . 0.0 108.201 170.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.468 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 6.3 p -113.59 145.86 18.94 Favored 'Isoleucine or valine' 0 C--O 1.243 0.752 0 C-N-CA 124.019 0.927 . . . . 0.0 110.349 -175.367 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.6 tt0 -78.67 -61.59 1.96 Allowed 'General case' 0 C--O 1.245 0.828 0 C-N-CA 124.042 0.937 . . . . 0.0 109.935 179.123 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 48.7 p -167.47 -172.09 1.85 Allowed 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 124.041 0.936 . . . . 0.0 110.024 -173.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.433 HD12 ' HB3' ' A' ' 22' ' ' TYR . 49.4 mm -102.2 133.6 45.3 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.61 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 171.14 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.476 ' HD2' ' HG3' ' A' ' 12' ' ' LYS . 0.6 OUTLIER -85.62 -58.67 2.57 Favored 'General case' 0 CA--C 1.553 1.079 0 C-N-CA 124.359 1.063 . . . . 0.0 109.19 -177.986 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.498 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 68.6 mttm -132.54 179.68 5.99 Favored 'General case' 0 N--CA 1.488 1.44 0 C-N-CA 123.788 0.835 . . . . 0.0 110.264 -175.379 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 83.8 tttt -156.24 154.63 31.03 Favored 'General case' 0 N--CA 1.473 0.72 0 N-CA-C 109.679 -0.489 . . . . 0.0 109.679 -169.977 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 2.6 ptm180 -164.41 170.54 15.88 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.421 1.088 . . . . 0.0 109.454 176.83 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 59.6 t -132.72 112.94 19.52 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 N-CA-C 107.005 -1.48 . . . . 0.0 107.005 171.724 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 2.7 tmm_? -129.9 112.7 13.8 Favored 'General case' 0 C--O 1.24 0.585 0 N-CA-C 108.659 -0.867 . . . . 0.0 108.659 -174.013 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 80.6 tttt 63.77 33.92 12.45 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 125.021 1.328 . . . . 0.0 110.199 -176.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 84.32 -14.85 43.16 Favored Glycine 0 C--N 1.35 1.341 0 CA-C-N 115.236 -0.893 . . . . 0.0 113.744 -179.37 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 9.7 mtmp? -84.2 112.38 20.21 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 123.412 0.685 . . . . 0.0 109.643 -179.606 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 20.2 t -79.12 106.52 10.27 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.487 0 N-CA-C 108.224 -1.028 . . . . 0.0 108.224 -179.487 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 49.1 mt-10 -103.77 137.16 42.18 Favored 'General case' 0 N--CA 1.469 0.493 0 C-N-CA 123.959 0.904 . . . . 0.0 110.755 -170.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.433 ' HB3' HD12 ' A' ' 10' ' ' ILE . 87.3 m-85 -119.0 126.83 52.64 Favored 'General case' 0 N--CA 1.465 0.287 0 C-N-CA 124.326 1.05 . . . . 0.0 109.224 -171.73 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.498 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 33.4 tp -74.47 84.67 2.01 Favored 'General case' 0 CA--C 1.539 0.524 0 N-CA-C 108.661 -0.866 . . . . 0.0 108.661 173.268 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.453 HG21 HD11 ' A' ' 42' ' ' ILE . 68.4 t -64.71 108.24 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.467 0.404 0 C-N-CA 124.625 1.17 . . . . 0.0 111.174 -174.793 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.421 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 25.6 tptp -94.64 102.23 14.12 Favored 'General case' 0 CA--C 1.544 0.714 0 CA-C-N 114.941 -1.027 . . . . 0.0 109.241 -179.748 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.568 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 21.1 m95 -74.72 152.58 39.09 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.663 0.785 . . . . 0.0 110.162 -178.0 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -80.7 -29.24 36.48 Favored 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 122.218 0.207 . . . . 0.0 111.262 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -94.36 -3.87 62.89 Favored Glycine 0 C--N 1.346 1.115 0 O-C-N 123.479 0.487 . . . . 0.0 113.023 179.781 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.568 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 62.0 m95 -124.23 127.86 25.2 Favored Pre-proline 0 CA--C 1.553 1.072 0 N-CA-C 108.933 -0.765 . . . . 0.0 108.933 -178.985 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 28.2 Cg_endo -60.44 163.78 14.42 Favored 'Trans proline' 0 C--N 1.379 2.148 0 C-N-CA 123.066 2.511 . . . . 0.0 112.234 174.761 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 35.3 Cg_endo -61.93 -10.15 16.61 Favored 'Trans proline' 0 C--N 1.386 2.545 0 C-N-CA 123.007 2.471 . . . . 0.0 114.843 -174.419 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.4 OUTLIER -66.84 -31.29 71.81 Favored 'General case' 0 N--CA 1.481 1.103 0 CA-C-N 117.815 0.279 . . . . 0.0 110.902 172.159 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.426 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 60.6 m-85 -98.51 10.82 40.06 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 112.122 -178.67 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 80.2 p -68.69 125.06 25.38 Favored 'General case' 0 CA--C 1.547 0.854 0 N-CA-C 108.866 -0.79 . . . . 0.0 108.866 175.808 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.525 HG21 HM32 ' B' ' 27' ' ' M3L . 22.5 p -112.95 129.97 56.29 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.631 0.772 . . . . 0.0 111.588 -169.313 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 98.5 m95 -68.94 82.26 0.31 Allowed 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.651 0.78 . . . . 0.0 110.708 175.845 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.414 ' HB2' HD11 ' A' ' 42' ' ' ILE . 21.5 mm-40 -107.9 115.68 58.39 Favored Pre-proline 0 C--O 1.243 0.749 0 C-N-CA 123.774 0.829 . . . . 0.0 109.149 177.583 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.461 ' O ' HG12 ' A' ' 42' ' ' ILE . 41.9 Cg_endo -63.68 168.91 10.84 Favored 'Trans proline' 0 C--N 1.368 1.579 0 C-N-CA 122.481 2.121 . . . . 0.0 112.048 170.346 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -62.5 -19.34 63.49 Favored 'General case' 0 N--CA 1.489 1.509 0 C-N-CA 123.659 0.784 . . . . 0.0 112.107 178.853 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 27.9 tt0 -59.17 -37.79 78.2 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 123.864 0.865 . . . . 0.0 111.129 169.122 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.8 m-70 -87.37 -18.18 30.65 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 124.486 1.114 . . . . 0.0 112.342 -177.261 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.528 HD12 ' HB1' ' B' ' 25' ' ' ALA . 42.0 mm -93.74 146.15 6.93 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.413 0 O-C-N 124.277 0.986 . . . . 0.0 111.657 -172.019 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.499 HD11 ' HE ' ' B' ' 26' ' ' ARG . 95.6 mt -87.91 -65.51 1.01 Allowed 'General case' 0 C--N 1.358 0.958 0 C-N-CA 123.577 0.751 . . . . 0.0 110.87 176.063 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 21.0 t70 -72.12 124.27 90.62 Favored Pre-proline 0 CA--C 1.55 0.962 0 C-N-CA 122.921 0.489 . . . . 0.0 110.143 -174.961 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 90.3 Cg_endo -74.57 -17.88 20.36 Favored 'Trans proline' 0 C--N 1.374 1.879 0 C-N-CA 122.734 2.289 . . . . 0.0 112.995 -174.869 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.543 ' HA ' ' HB3' ' A' ' 49' ' ' MET . 54.4 mtm180 -73.66 -11.44 60.41 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.113 -0.946 . . . . 0.0 112.784 -178.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.5 mm? -53.77 -53.7 48.62 Favored 'General case' 0 N--CA 1.492 1.652 0 CA-C-N 119.217 0.917 . . . . 0.0 110.925 173.223 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.516 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 2.7 p -69.3 -44.0 80.78 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 CA-C-N 115.977 -0.556 . . . . 0.0 110.156 176.726 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.543 ' HB3' ' HA ' ' A' ' 46' ' ' ARG . 23.2 ttt -57.05 -41.95 79.63 Favored 'General case' 0 N--CA 1.493 1.685 0 C-N-CA 123.395 0.678 . . . . 0.0 111.92 -177.213 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -68.22 -33.14 73.86 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.936 0.894 . . . . 0.0 110.436 -179.934 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.531 ' O ' ' HG2' ' A' ' 54' ' ' LYS . 67.7 t80 -75.17 -28.14 59.96 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.536 -1.211 . . . . 0.0 110.67 176.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.516 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 23.8 mm-40 -81.82 -6.86 59.44 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.773 0.429 . . . . 0.0 111.822 177.118 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 52.6 mt-10 -68.48 -18.49 64.41 Favored 'General case' 0 N--CA 1.483 1.206 0 C-N-CA 122.898 0.479 . . . . 0.0 111.513 175.861 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.531 ' HG2' ' O ' ' A' ' 51' ' ' TYR . 20.9 ptmt -91.94 -1.47 57.26 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.838 0.455 . . . . 0.0 111.859 -179.758 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 35.4 mm-40 -71.41 150.81 44.63 Favored 'General case' 0 N--CA 1.479 0.981 0 C-N-CA 123.162 0.585 . . . . 0.0 111.478 -178.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.3 mt-10 . . . . . 0 CA--C 1.55 0.98 0 C-N-CA 123.749 0.819 . . . . 0.0 109.494 -179.669 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 8.9 tt0 . . . . . 0 N--CA 1.483 1.208 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 53.8 tp 67.57 98.16 0.05 Allowed 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 125.032 1.333 . . . . 0.0 111.146 176.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -155.49 120.24 4.75 Favored 'General case' 0 N--CA 1.471 0.585 0 N-CA-C 108.003 -1.11 . . . . 0.0 108.003 175.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 6.2 t -73.76 120.53 19.48 Favored 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 121.37 0.605 . . . . 0.0 109.641 176.989 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 58.4 mttp -117.13 175.43 5.6 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 124.28 1.032 . . . . 0.0 110.079 -172.75 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -138.75 111.26 7.55 Favored 'General case' 0 C--O 1.239 0.537 0 C-N-CA 123.378 0.671 . . . . 0.0 109.502 176.097 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.528 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -99.37 167.53 10.58 Favored 'General case' 0 C--O 1.239 0.532 0 CA-C-N 114.932 -1.031 . . . . 0.0 108.868 174.515 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.503 ' HD3' ' HB3' ' B' ' 29' ' ' ALA . 15.2 ttm180 -134.7 152.21 51.59 Favored 'General case' 0 C--O 1.24 0.584 0 C-N-CA 123.255 0.622 . . . . 0.0 109.531 -176.704 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.664 HM13 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.239 0.544 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 172.835 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 32.4 t 72.59 -89.24 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.023 0.929 . . . . 0.0 110.42 173.995 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . 0.503 ' HB3' ' HD3' ' B' ' 26' ' ' ARG . . . 38.11 104.09 0.01 OUTLIER Pre-proline 0 C--N 1.373 1.614 0 C-N-CA 126.542 1.937 . . . . 0.0 115.373 170.376 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . 0.419 ' HD2' ' HA ' ' B' ' 29' ' ' ALA . 14.9 Cg_endo -53.15 102.68 0.08 OUTLIER 'Trans proline' 0 C--N 1.377 2.056 0 C-N-CA 123.013 2.475 . . . . 0.0 111.938 -177.805 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -73.57 163.01 28.59 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.772 0.829 . . . . 0.0 111.612 -175.897 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 33.1 p -64.32 93.9 0.1 Allowed 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 124.168 0.987 . . . . 0.0 111.692 -174.346 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.263 0 CA-C-N 114.98 -1.009 . . . . 0.0 111.936 176.179 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.22 0 N-CA-C 111.222 -0.751 . . . . 0.0 111.222 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 7.6 pt-20 -65.24 108.92 2.05 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.544 0.738 . . . . 0.0 110.157 176.416 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -133.07 152.04 51.99 Favored 'General case' 0 N--CA 1.475 0.811 0 CA-C-O 121.471 0.653 . . . . 0.0 111.27 178.849 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 60.7 t -117.42 131.99 68.53 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.584 0 C-N-CA 125.797 1.639 . . . . 0.0 107.871 177.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.421 ' HB2' ' CE3' ' A' ' 26' ' ' TRP . 69.1 m-85 -132.66 164.45 26.69 Favored 'General case' 0 C--O 1.248 0.98 0 N-CA-C 109.038 -0.726 . . . . 0.0 109.038 173.413 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -67.11 104.93 1.54 Allowed 'General case' 0 C--O 1.241 0.613 0 N-CA-C 107.934 -1.135 . . . . 0.0 107.934 168.184 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.519 HG13 HD11 ' A' ' 47' ' ' LEU . 2.9 p -89.57 138.57 19.06 Favored 'Isoleucine or valine' 0 C--O 1.243 0.711 0 CA-C-N 115.431 -0.804 . . . . 0.0 110.08 -178.302 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.598 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 38.2 tt0 -71.81 -62.56 1.37 Allowed 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.231 1.012 . . . . 0.0 109.561 176.52 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.404 ' HA ' HD12 ' A' ' 47' ' ' LEU . 27.7 p -173.6 -172.57 0.78 Allowed 'General case' 0 N--CA 1.476 0.858 0 C-N-CA 124.512 1.125 . . . . 0.0 109.216 -177.219 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.447 HD12 ' HB3' ' A' ' 22' ' ' TYR . 45.4 mm -94.78 133.16 36.64 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.802 0 N-CA-C 107.988 -1.116 . . . . 0.0 107.988 169.241 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 2.8 tmm_? -99.2 -37.06 9.45 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 123.186 0.594 . . . . 0.0 110.558 -174.489 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.441 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 65.9 mttm -143.69 169.96 16.76 Favored 'General case' 0 N--CA 1.484 1.244 0 C-N-CA 123.992 0.917 . . . . 0.0 109.921 176.54 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.0 tttt -152.48 149.29 28.39 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 108.835 -0.802 . . . . 0.0 108.835 -174.806 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -163.71 -175.47 4.15 Favored 'General case' 0 C--O 1.238 0.493 0 C-N-CA 124.414 1.085 . . . . 0.0 109.487 178.599 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 11.3 p -144.02 141.63 24.76 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 108.712 -0.847 . . . . 0.0 108.712 173.445 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.1 tpm_? -137.9 107.89 6.35 Favored 'General case' 0 C--O 1.236 0.385 0 C-N-CA 123.616 0.767 . . . . 0.0 109.045 176.641 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 92.4 mttt 61.75 36.5 16.26 Favored 'General case' 0 N--CA 1.482 1.154 0 C-N-CA 123.869 0.868 . . . . 0.0 111.482 173.559 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.62 -13.82 66.46 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 115.493 -0.776 . . . . 0.0 113.57 179.429 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 1.1 mmmp? -88.12 107.45 18.77 Favored 'General case' 0 N--CA 1.472 0.65 0 N-CA-C 108.475 -0.935 . . . . 0.0 108.475 179.32 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 14.9 t -83.53 108.49 16.12 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.635 0 N-CA-C 108.873 -0.788 . . . . 0.0 108.873 -175.862 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.8 mt-10 -96.52 138.75 33.64 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 123.465 0.706 . . . . 0.0 110.197 -169.928 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.447 ' HB3' HD12 ' A' ' 10' ' ' ILE . 71.1 m-85 -122.66 121.94 37.61 Favored 'General case' 0 N--CA 1.464 0.234 0 C-N-CA 123.898 0.879 . . . . 0.0 108.633 178.575 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.441 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 26.1 tp -71.68 86.64 0.93 Allowed 'General case' 0 C--O 1.24 0.583 0 N-CA-C 108.655 -0.868 . . . . 0.0 108.655 174.424 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 78.4 t -70.85 104.82 1.38 Allowed 'Isoleucine or valine' 0 C--O 1.238 0.468 0 CA-C-N 114.511 -1.222 . . . . 0.0 109.494 -176.237 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 21.6 tptm -81.37 100.24 9.13 Favored 'General case' 0 N--CA 1.451 -0.413 0 N-CA-C 108.363 -0.977 . . . . 0.0 108.363 176.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.421 ' CE3' ' HB2' ' A' ' 5' ' ' PHE . 21.7 m95 -76.14 124.43 27.41 Favored 'General case' 0 C--O 1.244 0.777 0 N-CA-C 107.348 -1.352 . . . . 0.0 107.348 172.497 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.598 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.0 OUTLIER -72.37 113.93 9.94 Favored 'General case' 0 CA--C 1.545 0.775 0 N-CA-C 108.893 -0.78 . . . . 0.0 108.893 176.658 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . 118.07 -14.65 12.4 Favored Glycine 0 C--N 1.346 1.139 0 CA-C-N 115.556 -0.747 . . . . 0.0 112.215 -172.494 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 59.8 m95 -110.07 135.19 20.54 Favored Pre-proline 0 N--CA 1.475 0.799 0 N-CA-C 108.703 -0.851 . . . . 0.0 108.703 172.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 16.4 Cg_endo -57.29 155.24 30.68 Favored 'Trans proline' 0 C--N 1.375 1.963 0 C-N-CA 122.746 2.297 . . . . 0.0 112.869 178.246 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 51.2 Cg_exo -56.43 -13.44 10.29 Favored 'Trans proline' 0 C--N 1.38 2.235 0 C-N-CA 123.52 2.813 . . . . 0.0 114.298 176.531 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 39.5 ttpt -82.75 -46.47 13.11 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 122.693 0.397 . . . . 0.0 110.196 172.725 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 15.2 m-30 -79.68 -1.36 37.99 Favored 'General case' 0 N--CA 1.488 1.437 0 C-N-CA 123.252 0.621 . . . . 0.0 112.206 -178.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 76.6 p -64.68 132.14 48.87 Favored 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 107.802 -1.184 . . . . 0.0 107.802 165.951 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . 0.687 HG21 HM32 ' B' ' 27' ' ' M3L . 38.1 p -109.75 138.21 46.44 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.039 0.536 . . . . 0.0 111.98 -166.428 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -74.29 87.31 1.98 Allowed 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.41 0.684 . . . . 0.0 110.107 177.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.7 mm-40 -103.74 125.1 35.63 Favored Pre-proline 0 N--CA 1.468 0.473 0 N-CA-C 109.501 -0.555 . . . . 0.0 109.501 177.345 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.43 ' O ' HG12 ' A' ' 42' ' ' ILE . 56.3 Cg_endo -67.55 166.37 24.14 Favored 'Trans proline' 0 C--N 1.368 1.597 0 C-N-CA 121.845 1.697 . . . . 0.0 112.447 172.451 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 7.9 pt-20 -52.24 -31.08 30.64 Favored 'General case' 0 N--CA 1.496 1.826 0 C-N-CA 125.457 1.503 . . . . 0.0 112.337 176.182 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 21.0 mt-10 -60.45 -35.75 76.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 125.518 1.527 . . . . 0.0 110.99 177.049 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 0.9 OUTLIER -91.65 -14.34 30.29 Favored 'General case' 0 N--CA 1.472 0.629 0 C-N-CA 124.2 1.0 . . . . 0.0 112.989 -175.073 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.43 HG12 ' O ' ' A' ' 38' ' ' PRO . 41.2 mm -88.41 153.07 3.29 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.408 0 C-N-CA 123.076 0.55 . . . . 0.0 110.914 -175.45 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.487 ' HB2' ' O ' ' B' ' 24' ' ' ALA . 89.1 mt -90.85 -67.22 0.86 Allowed 'General case' 0 C--N 1.353 0.736 0 N-CA-C 109.314 -0.624 . . . . 0.0 109.314 171.842 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.4 t70 -82.97 134.61 46.27 Favored Pre-proline 0 CA--C 1.565 1.555 0 C-N-CA 123.001 0.521 . . . . 0.0 110.588 -173.2 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . 0.43 ' HG2' ' HD3' ' A' ' 46' ' ' ARG . 88.9 Cg_endo -79.83 -32.04 1.66 Allowed 'Trans proline' 0 CA--C 1.571 2.342 0 C-N-CA 122.72 2.28 . . . . 0.0 116.072 -177.549 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.43 ' HD3' ' HG2' ' A' ' 45' ' ' PRO 0.26 0.0 OUTLIER -71.42 -11.38 60.85 Favored 'General case' 0 N--CA 1.513 2.686 0 N-CA-C 113.663 0.986 . . . . 0.0 113.663 -166.739 . . . . . . . . 4 4 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.519 HD11 HG13 ' A' ' 7' ' ' VAL . 2.9 mm? -53.54 -46.63 70.25 Favored 'General case' 0 N--CA 1.495 1.795 0 CA-C-N 118.807 0.731 . . . . 0.0 110.203 171.278 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 98.1 t -70.26 -42.38 78.85 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 CA-C-N 114.374 -1.285 . . . . 0.0 110.758 -177.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 25.8 mmt -68.98 -42.43 76.55 Favored 'General case' 0 N--CA 1.479 1.016 0 CA-C-N 115.135 -0.939 . . . . 0.0 111.406 -175.095 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -65.21 -30.91 71.85 Favored 'General case' 0 N--CA 1.486 1.35 0 C-N-CA 123.951 0.9 . . . . 0.0 111.868 178.775 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.5 t80 -70.02 -52.27 25.49 Favored 'General case' 0 CA--C 1.554 1.101 0 CA-C-N 115.058 -0.974 . . . . 0.0 111.015 177.761 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -81.76 -17.7 46.78 Favored 'General case' 0 N--CA 1.483 1.219 0 N-CA-C 113.031 0.752 . . . . 0.0 113.031 -172.032 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -69.38 -32.38 71.37 Favored 'General case' 0 N--CA 1.486 1.326 0 CA-C-N 117.992 0.36 . . . . 0.0 111.742 -176.268 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 13.9 ptmm? -91.15 147.4 23.09 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.544 0.737 . . . . 0.0 109.473 -179.084 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.9 mp0 60.46 96.06 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 125.143 1.377 . . . . 0.0 111.152 -171.613 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 CA--C 1.56 1.345 0 CA-C-O 118.255 -0.879 . . . . 0.0 110.525 -176.549 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 30.7 tt0 . . . . . 0 N--CA 1.476 0.866 0 N-CA-C 110.112 -0.329 . . . . 0.0 110.112 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 3.6 mm? -107.89 62.35 0.61 Allowed 'General case' 0 N--CA 1.483 1.181 0 N-CA-C 108.412 -0.958 . . . . 0.0 108.412 169.086 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -153.52 -174.32 4.9 Favored 'General case' 0 C--O 1.243 0.716 0 CA-C-N 114.326 -1.306 . . . . 0.0 109.086 -177.394 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 74.4 p 54.06 29.83 10.91 Favored 'General case' 0 N--CA 1.493 1.716 0 C-N-CA 124.713 1.205 . . . . 0.0 111.632 -175.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . 0.483 ' HE3' ' HA ' ' B' ' 23' ' ' LYS . 0.0 OUTLIER -87.22 176.4 7.58 Favored 'General case' 0 N--CA 1.469 0.503 0 CA-C-N 115.182 -0.917 . . . . 0.0 108.747 176.213 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . 0.487 ' O ' ' HB2' ' A' ' 43' ' ' LEU . . . -117.79 112.34 20.27 Favored 'General case' 0 C--N 1.32 -0.688 0 N-CA-C 108.81 -0.811 . . . . 0.0 108.81 178.874 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -103.08 168.61 9.07 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 107.533 -1.284 . . . . 0.0 107.533 166.947 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.451 ' NH1' ' HA ' ' B' ' 30' ' ' PRO . 75.3 ttt180 -145.56 163.1 35.81 Favored 'General case' 0 N--CA 1.471 0.58 0 CA-C-O 120.789 0.328 . . . . 0.0 110.139 -172.488 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.687 HM32 HG21 ' A' ' 35' ' ' THR . . . . . . . . 0 CA--C 1.544 0.712 0 N-CA-C 112.665 0.617 . . . . 0.0 112.665 178.794 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 56.4 m -165.8 173.31 10.77 Favored 'General case' 0 N--CA 1.494 1.775 0 C-N-CA 122.819 0.448 . . . . 0.0 111.435 -172.926 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -58.77 139.59 86.31 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 124.054 0.941 . . . . 0.0 111.886 -179.331 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . 0.451 ' HA ' ' NH1' ' B' ' 26' ' ' ARG . 47.3 Cg_exo -59.79 -17.17 41.74 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 123.191 2.594 . . . . 0.0 113.579 174.972 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . 65.75 19.19 11.35 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.711 1.204 . . . . 0.0 111.654 -179.939 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 43.5 p -113.64 150.34 33.31 Favored 'General case' 0 C--O 1.243 0.718 0 C-N-CA 124.533 1.133 . . . . 0.0 109.724 -178.746 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.537 1.418 0 CA-C-O 118.73 -1.039 . . . . 0.0 111.882 177.425 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 2.125 0 N-CA-C 112.012 -0.435 . . . . 0.0 112.012 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.414 ' HA ' ' HB3' ' B' ' 28' ' ' SER . 4.2 mp0 62.12 9.76 3.33 Favored 'General case' 0 N--CA 1.492 1.639 0 C-N-CA 124.769 1.228 . . . . 0.0 113.754 171.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 40.1 tt0 -93.99 142.82 26.95 Favored 'General case' 0 C--O 1.248 1.026 0 CA-C-O 121.338 0.59 . . . . 0.0 110.887 -169.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 39.1 t -105.33 140.31 23.76 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 CA-C-N 114.255 -1.339 . . . . 0.0 109.371 -178.391 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 95.0 m-85 -132.1 152.27 51.31 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.776 0.83 . . . . 0.0 109.166 174.067 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -65.03 128.27 35.09 Favored 'General case' 0 C--O 1.244 0.784 0 N-CA-C 108.914 -0.773 . . . . 0.0 108.914 172.855 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 7.2 p -121.46 132.47 70.62 Favored 'Isoleucine or valine' 0 C--O 1.243 0.712 0 CA-C-N 115.343 -0.844 . . . . 0.0 110.439 -170.154 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 28.8 tt0 -69.29 -61.7 1.68 Allowed 'General case' 0 C--O 1.241 0.619 0 CA-C-N 115.174 -0.921 . . . . 0.0 109.996 -178.479 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.8 p -167.59 -169.34 1.18 Allowed 'General case' 0 CA--C 1.539 0.522 0 CA-C-N 114.853 -1.067 . . . . 0.0 109.758 -172.454 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.527 HD12 ' HB3' ' A' ' 22' ' ' TYR . 51.2 mm -105.5 139.62 26.06 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.629 0 N-CA-C 108.064 -1.087 . . . . 0.0 108.064 168.418 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.432 ' HB3' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -92.64 -48.5 6.56 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.676 0.791 . . . . 0.0 109.97 -179.875 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 68.5 mttm -137.53 161.47 36.31 Favored 'General case' 0 N--CA 1.484 1.24 0 C-N-CA 123.395 0.678 . . . . 0.0 111.156 -176.87 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 86.0 tttt -146.22 142.91 28.86 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.819 0.848 . . . . 0.0 109.179 -177.4 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 36.7 ptt180 -165.13 143.99 6.54 Favored 'General case' 0 CA--C 1.541 0.624 0 C-N-CA 123.788 0.835 . . . . 0.0 109.137 178.977 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 20' ' ' VAL . 7.2 p -92.09 125.29 44.75 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.872 0 N-CA-C 108.903 -0.777 . . . . 0.0 108.903 172.943 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 10.3 tpt180 -133.15 104.52 6.54 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 122.992 0.517 . . . . 0.0 109.611 -169.415 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 64.6 mttm 62.52 30.64 17.16 Favored 'General case' 0 N--CA 1.486 1.335 0 C-N-CA 124.008 0.923 . . . . 0.0 110.656 -179.056 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 89.04 -17.46 51.07 Favored Glycine 0 C--N 1.348 1.237 0 CA-C-N 115.312 -0.858 . . . . 0.0 113.569 -174.045 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 13.8 mmmm -94.87 109.99 21.92 Favored 'General case' 0 N--CA 1.469 0.48 0 C-N-CA 123.632 0.773 . . . . 0.0 109.272 -177.338 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.521 ' HA ' ' HA ' ' A' ' 15' ' ' VAL . 24.7 t -79.24 111.44 16.08 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.444 0 N-CA-C 109.426 -0.583 . . . . 0.0 109.426 -176.024 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -90.53 143.75 26.45 Favored 'General case' 0 C--O 1.242 0.69 0 C-N-CA 123.696 0.798 . . . . 0.0 109.786 -177.411 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.527 ' HB3' HD12 ' A' ' 10' ' ' ILE . 98.6 m-85 -125.94 123.51 38.72 Favored 'General case' 0 C--N 1.328 -0.344 0 N-CA-C 107.802 -1.185 . . . . 0.0 107.802 177.315 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.432 HD23 ' HB3' ' A' ' 11' ' ' ARG . 43.1 tp -71.47 84.23 0.82 Allowed 'General case' 0 N--CA 1.466 0.349 0 N-CA-C 107.751 -1.203 . . . . 0.0 107.751 169.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.662 HG21 HD11 ' A' ' 42' ' ' ILE . 99.8 t -69.09 104.37 0.91 Allowed 'Isoleucine or valine' 0 C--O 1.24 0.592 0 CA-C-N 114.833 -1.076 . . . . 0.0 110.086 -172.395 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 19.2 tptm -78.06 99.76 6.24 Favored 'General case' 0 C--O 1.239 0.538 0 CA-C-N 115.189 -0.914 . . . . 0.0 108.899 -179.296 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.535 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 78.8 m95 -69.07 139.54 54.83 Favored 'General case' 0 CA--C 1.535 0.403 0 CA-C-N 115.215 -0.902 . . . . 0.0 108.958 176.619 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 37.6 ttpt -69.18 -31.63 70.37 Favored 'General case' 0 CA--C 1.549 0.922 0 CA-C-O 120.718 0.294 . . . . 0.0 110.559 -178.431 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -82.74 -26.16 47.07 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 115.929 -0.578 . . . . 0.0 113.616 179.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.535 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 94.4 m95 -110.87 138.48 21.13 Favored Pre-proline 0 N--CA 1.482 1.139 0 C-N-CA 122.968 0.507 . . . . 0.0 111.363 -172.3 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 84.2 Cg_exo -52.95 157.65 7.72 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 123.526 2.817 . . . . 0.0 113.248 173.359 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 45.7 Cg_exo -57.82 -20.24 42.77 Favored 'Trans proline' 0 C--N 1.383 2.362 0 C-N-CA 123.327 2.685 . . . . 0.0 113.925 179.316 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 16.8 ptpt -80.77 -31.39 35.87 Favored 'General case' 0 CA--C 1.551 0.996 0 C-N-CA 123.377 0.671 . . . . 0.0 111.434 176.361 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 79.5 m-85 -88.9 -4.37 58.48 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 123.383 0.673 . . . . 0.0 111.174 174.384 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 58.8 m -68.19 137.45 54.84 Favored 'General case' 0 N--CA 1.47 0.545 0 C-N-CA 123.216 0.607 . . . . 0.0 109.606 172.071 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 36.9 p -111.88 143.2 43.23 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.051 0.541 . . . . 0.0 111.826 -170.079 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -75.57 85.66 2.64 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.669 0.788 . . . . 0.0 110.145 177.633 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.507 ' HB2' HD11 ' A' ' 42' ' ' ILE . 28.1 mm-40 -102.98 128.06 28.53 Favored Pre-proline 0 C--O 1.238 0.465 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 175.265 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -68.15 162.28 40.85 Favored 'Trans proline' 0 C--N 1.365 1.429 0 C-N-CA 121.753 1.636 . . . . 0.0 110.9 170.015 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -60.98 -16.48 43.45 Favored 'General case' 0 N--CA 1.491 1.591 0 C-N-CA 122.984 0.514 . . . . 0.0 112.01 179.749 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.6 mm-40 -55.67 -50.84 69.17 Favored 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 124.803 1.241 . . . . 0.0 109.996 170.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -76.96 -16.67 59.28 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-N 114.342 -1.299 . . . . 0.0 112.732 -174.515 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.662 HD11 HG21 ' A' ' 24' ' ' VAL . 46.0 mm -91.43 147.03 5.54 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.938 0 C-N-CA 124.207 1.003 . . . . 0.0 111.161 -172.624 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 62.6 mt -87.34 -71.12 0.58 Allowed 'General case' 0 C--N 1.356 0.849 0 C-N-CA 122.966 0.506 . . . . 0.0 109.641 172.511 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . 0.432 ' O ' HD23 ' A' ' 47' ' ' LEU . 14.3 t70 -68.92 112.58 11.94 Favored Pre-proline 0 CA--C 1.556 1.185 0 C-N-CA 122.919 0.488 . . . . 0.0 110.024 -176.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 62.2 Cg_endo -81.65 -9.15 12.32 Favored 'Trans proline' 0 C--N 1.374 1.891 0 C-N-CA 122.479 2.12 . . . . 0.0 113.187 -176.61 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 7.2 ttp180 -70.98 -16.54 62.64 Favored 'General case' 0 CA--C 1.547 0.838 0 C-N-CA 123.787 0.835 . . . . 0.0 110.081 -178.197 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.432 HD23 ' O ' ' A' ' 44' ' ' ASP . 4.5 mm? -49.88 -47.39 52.01 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 123.759 0.824 . . . . 0.0 111.513 169.28 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 48.9 t -67.97 -50.43 59.28 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.83 0 C-N-CA 123.823 0.849 . . . . 0.0 110.615 -178.089 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.411 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 25.8 mmt -58.5 -53.27 60.19 Favored 'General case' 0 N--CA 1.482 1.151 0 CA-C-N 114.647 -1.161 . . . . 0.0 111.072 -177.04 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.06 -35.89 78.15 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.574 1.15 . . . . 0.0 112.164 -177.09 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 17.9 t80 -62.63 -55.11 30.1 Favored 'General case' 0 CA--C 1.543 0.696 0 CA-C-N 115.535 -0.757 . . . . 0.0 110.548 177.341 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.5 mt-10 -74.82 -6.18 47.62 Favored 'General case' 0 N--CA 1.482 1.174 0 N-CA-C 113.67 0.989 . . . . 0.0 113.67 -170.467 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.411 ' HG3' ' O ' ' A' ' 49' ' ' MET . 60.7 mt-10 -60.81 -31.2 70.6 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.02 0.438 . . . . 0.0 110.687 171.708 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -136.06 137.71 41.39 Favored 'General case' 0 CA--C 1.544 0.721 0 C-N-CA 123.897 0.879 . . . . 0.0 108.817 179.828 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 49.2 mt-10 65.12 98.7 0.04 OUTLIER 'General case' 0 CA--C 1.555 1.172 0 C-N-CA 124.122 0.969 . . . . 0.0 111.855 -175.984 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.25 1.086 0 N-CA-C 107.983 -1.118 . . . . 0.0 107.983 176.303 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 80.5 mt-30 . . . . . 0 N--CA 1.479 1.004 0 CA-C-O 120.989 0.423 . . . . 0.0 110.578 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 3.3 mm? -112.32 135.72 52.66 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.146 -1.057 . . . . 0.0 108.146 172.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -169.43 -174.1 1.85 Allowed 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.577 0.751 . . . . 0.0 110.253 -177.144 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 5.2 t -67.62 84.19 0.18 Allowed 'General case' 0 CA--C 1.549 0.93 0 CA-C-O 122.45 1.119 . . . . 0.0 109.91 172.416 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . 0.419 ' HE2' HD22 ' A' ' 47' ' ' LEU . 7.3 mtpm? -135.03 123.0 22.59 Favored 'General case' 0 C--O 1.244 0.796 0 CA-C-N 114.204 -1.362 . . . . 0.0 107.928 179.686 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -136.77 130.09 31.43 Favored 'General case' 0 C--O 1.24 0.588 0 CA-C-O 121.557 0.694 . . . . 0.0 110.28 -178.602 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.63 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -109.73 166.34 10.99 Favored 'General case' 0 C--O 1.239 0.518 0 CA-C-N 114.379 -1.282 . . . . 0.0 108.729 178.284 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . . . . . . . . . 37.5 ttt180 -131.48 157.29 43.92 Favored 'General case' 0 C--O 1.239 0.533 0 C-N-CA 123.343 0.657 . . . . 0.0 109.326 -172.106 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.797 0 C-N-CA 122.95 0.5 . . . . 0.0 111.524 -179.523 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.414 ' HB3' ' HA ' ' A' ' 2' ' ' GLU . 33.3 t -159.27 138.4 11.21 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.476 0.179 . . . . 0.0 111.019 -172.878 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -76.6 118.81 74.15 Favored Pre-proline 0 CA--C 1.545 0.771 0 C-N-CA 123.581 0.752 . . . . 0.0 110.468 -177.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 55.5 Cg_endo -67.31 -9.28 24.67 Favored 'Trans proline' 0 C--N 1.381 2.248 0 C-N-CA 122.651 2.234 . . . . 0.0 112.602 174.84 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -88.89 3.55 50.97 Favored 'General case' 0 CA--C 1.547 0.834 0 C-N-CA 123.937 0.895 . . . . 0.0 112.504 179.763 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 11.0 t -78.61 -28.76 45.71 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 122.558 0.343 . . . . 0.0 111.448 -177.25 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.12 0 CA-C-O 118.811 -0.994 . . . . 0.0 111.292 -176.085 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.47 0.9 0 N-CA-C 111.703 -0.559 . . . . 0.0 111.703 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.5 tt0 -158.83 93.44 1.17 Allowed 'General case' 0 N--CA 1.47 0.57 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 177.457 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.434 ' HB2' ' HB3' ' B' ' 27' ' ' M3L . 26.9 mp0 -112.06 90.61 3.39 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 123.591 0.756 . . . . 0.0 109.609 -178.293 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.556 HG22 ' HB3' ' B' ' 26' ' ' ARG . 48.4 t -85.74 103.94 13.02 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.651 0 C-N-CA 123.721 0.808 . . . . 0.0 109.092 179.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 69.7 m-85 -129.38 174.13 9.9 Favored 'General case' 0 N--CA 1.481 1.105 0 C-N-CA 123.458 0.703 . . . . 0.0 110.703 -179.573 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -81.76 114.26 20.28 Favored 'General case' 0 C--O 1.245 0.864 0 CA-C-N 115.148 -0.933 . . . . 0.0 110.013 178.772 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.613 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.7 p -107.72 149.49 11.04 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.741 0 C-N-CA 124.658 1.183 . . . . 0.0 109.93 -178.831 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.562 ' HB2' ' HB3' ' A' ' 27' ' ' LYS . 8.1 tp10 -86.02 -59.0 2.42 Favored 'General case' 0 CA--C 1.534 0.363 0 CA-C-O 120.925 0.393 . . . . 0.0 109.992 174.834 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.487 ' HA ' HD12 ' A' ' 47' ' ' LEU . 15.9 p -169.6 179.89 3.61 Favored 'General case' 0 N--CA 1.471 0.619 0 CA-C-N 115.383 -0.826 . . . . 0.0 109.77 -171.289 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.592 HD12 ' HB3' ' A' ' 22' ' ' TYR . 40.9 mm -86.64 128.61 39.41 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.508 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 172.056 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.503 ' HD2' HD23 ' A' ' 23' ' ' LEU . 0.0 OUTLIER -76.28 -49.3 17.38 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.887 0.875 . . . . 0.0 109.472 176.518 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . . . . . . . . . 40.8 tttp -148.72 164.71 33.56 Favored 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 122.61 0.364 . . . . 0.0 110.054 -172.483 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 87.5 tttt -142.24 154.01 44.42 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.151 0.58 . . . . 0.0 109.462 -171.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . 0.568 ' HG3' ' HB2' ' A' ' 21' ' ' GLU . 10.0 ptm180 -171.45 -174.24 1.38 Allowed 'General case' 0 N--CA 1.47 0.533 0 C-N-CA 125.247 1.419 . . . . 0.0 108.831 179.394 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.5 p -143.71 142.51 24.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.549 0 N-CA-C 108.656 -0.868 . . . . 0.0 108.656 174.496 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 29.4 tpt180 -137.33 104.65 5.44 Favored 'General case' 0 CA--C 1.537 0.456 0 C-N-CA 123.584 0.754 . . . . 0.0 109.069 -177.489 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 21.2 ttmm 59.72 34.35 22.03 Favored 'General case' 0 CA--C 1.558 1.25 0 C-N-CA 124.786 1.234 . . . . 0.0 111.302 177.869 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.79 -14.57 65.01 Favored Glycine 0 C--N 1.346 1.094 0 CA-C-N 115.241 -0.89 . . . . 0.0 114.292 179.091 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 66.5 mttm -85.2 109.87 18.62 Favored 'General case' 0 N--CA 1.477 0.902 0 N-CA-C 108.739 -0.838 . . . . 0.0 108.739 175.405 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 23.6 t -78.22 111.05 14.61 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.509 0 N-CA-C 109.344 -0.613 . . . . 0.0 109.344 -175.488 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.568 ' HB2' ' HG3' ' A' ' 14' ' ' ARG . 5.3 mm-40 -95.86 140.27 30.87 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.865 0.866 . . . . 0.0 110.575 -168.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.592 ' HB3' HD12 ' A' ' 10' ' ' ILE . 91.6 m-85 -129.99 121.52 26.69 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.871 0.868 . . . . 0.0 109.146 -178.416 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.503 HD23 ' HD2' ' A' ' 11' ' ' ARG . 24.0 tp -73.68 80.06 1.53 Allowed 'General case' 0 N--CA 1.47 0.574 0 N-CA-C 108.845 -0.798 . . . . 0.0 108.845 173.3 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.568 HG21 HD11 ' A' ' 42' ' ' ILE . 40.8 t -65.17 106.18 0.61 Allowed 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 C-N-CA 124.525 1.13 . . . . 0.0 109.708 -175.881 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.447 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 13.7 tptm -90.3 104.61 17.17 Favored 'General case' 0 C--O 1.243 0.749 0 C-N-CA 123.239 0.615 . . . . 0.0 110.019 -177.484 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.613 ' HA ' ' HA ' ' A' ' 7' ' ' VAL . 36.9 m95 -77.56 127.07 31.89 Favored 'General case' 0 CA--C 1.539 0.526 0 C-N-CA 124.238 1.015 . . . . 0.0 108.937 -179.755 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.562 ' HB3' ' HB2' ' A' ' 8' ' ' GLU . 0.1 OUTLIER -64.5 -28.8 69.9 Favored 'General case' 0 N--CA 1.481 1.116 0 N-CA-C 113.044 0.757 . . . . 0.0 113.044 -166.466 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -101.17 -2.81 54.46 Favored Glycine 0 C--N 1.349 1.302 0 CA-C-N 116.749 -0.205 . . . . 0.0 113.209 -177.2 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.595 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 76.9 m95 -111.44 150.09 41.6 Favored Pre-proline 0 N--CA 1.475 0.808 0 C-N-CA 123.642 0.777 . . . . 0.0 110.727 -173.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 42.5 Cg_endo -64.73 158.54 50.02 Favored 'Trans proline' 0 C--N 1.381 2.244 0 C-N-CA 122.861 2.374 . . . . 0.0 111.836 177.51 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 34.5 Cg_endo -62.81 -18.53 64.98 Favored 'Trans proline' 0 C--N 1.378 2.103 0 C-N-CA 123.067 2.511 . . . . 0.0 113.686 -179.094 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 65.5 pttt -71.55 -30.01 65.4 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 122.573 0.349 . . . . 0.0 110.511 173.993 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.506 ' HD2' HM11 ' B' ' 27' ' ' M3L . 12.6 m-85 -86.36 -5.03 59.26 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.712 0.805 . . . . 0.0 111.862 176.982 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 32.9 t -68.92 123.88 22.19 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 108.637 -0.875 . . . . 0.0 108.637 170.783 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 17.7 p -115.87 136.74 52.75 Favored 'General case' 0 N--CA 1.488 1.472 0 C-N-CA 124.119 0.967 . . . . 0.0 112.12 -165.298 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 90.5 m95 -76.5 84.92 3.21 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 109.554 -0.535 . . . . 0.0 109.554 172.945 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.517 ' HB2' HD11 ' A' ' 42' ' ' ILE . 49.1 mm-40 -101.05 140.4 21.27 Favored Pre-proline 0 N--CA 1.474 0.742 0 C-N-CA 123.358 0.663 . . . . 0.0 109.222 176.613 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 89.7 Cg_endo -78.48 158.97 29.07 Favored 'Trans proline' 0 C--N 1.371 1.751 0 C-N-CA 121.794 1.663 . . . . 0.0 111.602 174.304 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -54.9 -25.01 26.27 Favored 'General case' 0 N--CA 1.493 1.711 0 C-N-CA 123.907 0.883 . . . . 0.0 112.083 174.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 11.2 tp10 -59.3 -31.46 69.15 Favored 'General case' 0 CA--C 1.552 1.026 0 C-N-CA 124.685 1.194 . . . . 0.0 112.077 177.61 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.506 ' HB3' ' HB2' ' B' ' 28' ' ' SER . 14.8 m-70 -127.83 25.0 6.02 Favored 'General case' 0 C--O 1.25 1.083 0 C-N-CA 123.753 0.821 . . . . 0.0 112.538 -170.198 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.568 HD11 HG21 ' A' ' 24' ' ' VAL . 37.5 mm -103.9 150.8 6.92 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.198 0 C-N-CA 125.041 1.336 . . . . 0.0 110.293 168.934 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.492 ' HB2' ' HG2' ' B' ' 26' ' ' ARG . 4.9 tt -81.23 -82.57 0.12 Allowed 'General case' 0 CA--C 1.547 0.862 0 C-N-CA 124.225 1.01 . . . . 0.0 108.826 -178.174 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.5 t70 -78.5 132.51 65.35 Favored Pre-proline 0 CA--C 1.559 1.31 0 N-CA-C 108.934 -0.765 . . . . 0.0 108.934 -177.893 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 78.0 Cg_endo -80.45 -16.82 10.46 Favored 'Trans proline' 0 C--N 1.377 2.028 0 C-N-CA 122.57 2.18 . . . . 0.0 113.711 -178.37 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . 0.438 ' HA ' ' HB2' ' A' ' 49' ' ' MET . 65.1 mtm180 -71.98 -11.12 60.62 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 123.866 0.866 . . . . 0.0 113.203 -176.038 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.497 HD11 HG13 ' A' ' 7' ' ' VAL . 3.1 mm? -58.7 -44.49 90.36 Favored 'General case' 0 N--CA 1.488 1.474 0 CA-C-N 118.774 0.715 . . . . 0.0 109.812 167.657 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 90.5 t -69.37 -44.21 80.41 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 124.386 1.074 . . . . 0.0 110.52 178.584 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.438 ' HB2' ' HA ' ' A' ' 46' ' ' ARG . 96.0 mmm -65.25 -51.64 59.54 Favored 'General case' 0 N--CA 1.478 0.957 0 CA-C-N 114.935 -1.03 . . . . 0.0 111.196 -176.647 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -61.08 -30.68 70.49 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.955 0.902 . . . . 0.0 111.547 179.029 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 49.5 t80 -65.92 -49.17 68.91 Favored 'General case' 0 CA--C 1.548 0.899 0 C-N-CA 123.001 0.521 . . . . 0.0 110.304 175.572 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 41.8 mt-10 -84.17 -5.71 59.29 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 123.679 0.792 . . . . 0.0 112.28 -177.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 33.7 mm-40 -66.63 -29.12 69.08 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.592 0.757 . . . . 0.0 110.191 168.434 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.455 ' HD2' ' N ' ' A' ' 54' ' ' LYS . 3.0 mptp? -101.57 150.85 22.65 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.85 0.86 . . . . 0.0 109.87 178.672 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 15.2 mm-40 57.16 77.88 0.25 Allowed 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 125.057 1.343 . . . . 0.0 111.879 178.194 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.3 pt-20 . . . . . 0 C--O 1.253 1.271 0 CA-C-O 119.043 -0.503 . . . . 0.0 109.98 178.029 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 22.1 pt20 . . . . . 0 N--CA 1.481 1.12 0 CA-C-O 120.81 0.338 . . . . 0.0 110.777 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 48.3 mt -87.81 136.17 33.07 Favored 'General case' 0 N--CA 1.475 0.8 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 179.708 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.504 ' HB3' ' O ' ' A' ' 8' ' ' GLU . . . -77.95 -27.48 49.28 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 123.217 0.607 . . . . 0.0 110.985 -177.625 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 10.2 t 42.06 67.24 0.6 Allowed 'General case' 0 N--CA 1.495 1.783 0 C-N-CA 125.665 1.586 . . . . 0.0 114.095 176.362 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 47.3 mmtm -128.29 159.12 36.26 Favored 'General case' 0 N--CA 1.483 1.192 0 C-N-CA 124.182 0.993 . . . . 0.0 110.427 -179.633 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -104.2 134.31 47.65 Favored 'General case' 0 C--N 1.328 -0.36 0 N-CA-C 108.768 -0.827 . . . . 0.0 108.768 171.657 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -119.54 -175.6 2.98 Favored 'General case' 0 C--O 1.24 0.595 0 N-CA-C 108.158 -1.052 . . . . 0.0 108.158 171.533 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.556 ' HB3' HG22 ' A' ' 4' ' ' VAL . 4.5 ptp180 -143.58 141.53 30.69 Favored 'General case' 0 N--CA 1.467 0.396 0 C-N-CA 123.4 0.68 . . . . 0.0 109.591 -178.248 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.506 HM11 ' HD2' ' A' ' 33' ' ' TYR . . . . . . . . 0 C--O 1.237 0.42 0 N-CA-C 107.609 -1.256 . . . . 0.0 107.609 168.153 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.506 ' HB2' ' HB3' ' A' ' 41' ' ' HIS . 69.5 m -85.55 128.51 34.77 Favored 'General case' 0 N--CA 1.47 0.564 0 N-CA-C 109.132 -0.692 . . . . 0.0 109.132 175.133 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.04 128.66 92.64 Favored Pre-proline 0 CA--C 1.546 0.8 0 C-N-CA 123.481 0.712 . . . . 0.0 111.478 -171.316 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 12.6 Cg_exo -70.1 97.42 0.66 Allowed 'Trans proline' 0 C--N 1.367 1.538 0 C-N-CA 122.168 1.912 . . . . 0.0 110.189 168.231 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -57.55 -32.42 67.09 Favored 'General case' 0 N--CA 1.485 1.299 0 C-N-CA 123.712 0.805 . . . . 0.0 110.641 177.718 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 24.5 m -101.79 103.04 13.74 Favored 'General case' 0 CA--C 1.538 0.515 0 N-CA-C 108.147 -1.057 . . . . 0.0 108.147 166.516 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.094 0 CA-C-O 118.67 -1.072 . . . . 0.0 110.706 174.527 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.462 0 N-CA-C 112.251 -0.34 . . . . 0.0 112.251 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.447 ' HG3' ' NH2' ' B' ' 26' ' ' ARG . 1.2 pm0 -109.68 138.87 45.42 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.419 1.088 . . . . 0.0 109.277 179.986 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 24.4 pt20 -159.29 150.65 20.15 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.95 0.5 . . . . 0.0 111.538 -170.828 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 64.9 t -100.66 140.12 20.38 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.245 0 C-N-CA 124.189 0.995 . . . . 0.0 110.549 -177.337 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 70.2 m-85 -142.28 163.28 33.29 Favored 'General case' 0 N--CA 1.482 1.168 0 C-N-CA 124.062 0.945 . . . . 0.0 110.195 171.854 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -75.84 153.55 36.75 Favored 'General case' 0 C--O 1.243 0.737 0 CA-C-N 115.297 -0.865 . . . . 0.0 110.013 174.475 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.462 HG11 ' HB2' ' B' ' 25' ' ' ALA . 7.3 p -155.31 153.56 7.7 Favored 'Isoleucine or valine' 0 C--O 1.241 0.645 0 C-N-CA 124.311 1.045 . . . . 0.0 108.415 -176.457 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 60.6 tt0 -121.9 -36.77 2.95 Favored 'General case' 0 C--O 1.243 0.711 0 CA-C-N 116.319 -0.401 . . . . 0.0 110.722 175.179 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 20.3 m -133.75 138.86 46.0 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 116.134 -0.485 . . . . 0.0 111.561 -166.06 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 49.8 mm -91.08 111.82 24.31 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.501 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 161.864 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -69.98 -54.19 14.38 Favored 'General case' 0 N--CA 1.479 1.014 0 O-C-N 123.708 0.63 . . . . 0.0 109.997 -173.943 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.421 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 99.2 mttt -139.2 176.84 8.36 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.823 0.849 . . . . 0.0 110.568 -178.472 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 81.0 tttt -157.91 143.16 16.81 Favored 'General case' 0 N--CA 1.466 0.368 0 C-N-CA 124.215 1.006 . . . . 0.0 108.933 -173.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 9.5 ptm180 -155.51 166.02 34.8 Favored 'General case' 0 N--CA 1.47 0.555 0 C-N-CA 124.085 0.954 . . . . 0.0 108.582 178.394 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 25.4 t -127.86 114.78 36.69 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.808 0 N-CA-C 108.658 -0.868 . . . . 0.0 108.658 177.089 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.422 ' HD3' ' OE1' ' A' ' 21' ' ' GLU . 74.5 mtp180 -125.34 115.95 21.14 Favored 'General case' 0 C--O 1.238 0.49 0 C-N-CA 123.983 0.913 . . . . 0.0 108.92 -178.566 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 44.1 mtmt 64.21 24.76 13.47 Favored 'General case' 0 N--CA 1.488 1.47 0 C-N-CA 125.458 1.503 . . . . 0.0 111.55 -179.215 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 92.04 -16.04 60.5 Favored Glycine 0 C--N 1.345 1.028 0 CA-C-N 116.061 -0.518 . . . . 0.0 112.755 -177.491 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 76.0 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.47 0.543 0 N-CA-C 108.831 -0.804 . . . . 0.0 108.831 178.254 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 24.4 t -82.65 109.09 16.17 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.389 0 N-CA-C 108.731 -0.84 . . . . 0.0 108.731 -178.379 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.422 ' OE1' ' HD3' ' A' ' 16' ' ' ARG . 50.9 mt-10 -94.81 141.47 28.59 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.801 0.84 . . . . 0.0 110.279 -176.762 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 92.5 m-85 -120.18 120.49 36.31 Favored 'General case' 0 N--CA 1.468 0.468 0 C-N-CA 124.283 1.033 . . . . 0.0 108.784 -179.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.421 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 33.9 tp -71.58 86.97 0.9 Allowed 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.303 -0.999 . . . . 0.0 108.303 172.799 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.6 t -73.17 107.98 4.19 Favored 'Isoleucine or valine' 0 C--O 1.241 0.629 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.976 -173.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.452 ' O ' HG23 ' A' ' 7' ' ' VAL . 20.5 tptm -78.69 99.89 6.81 Favored 'General case' 0 CA--C 1.539 0.544 0 N-CA-C 108.402 -0.962 . . . . 0.0 108.402 175.945 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . . . . . . . . . 68.0 m95 -69.94 129.67 40.12 Favored 'General case' 0 CA--C 1.535 0.388 0 N-CA-C 108.236 -1.024 . . . . 0.0 108.236 175.202 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -71.27 -20.59 62.2 Favored 'General case' 0 N--CA 1.478 0.937 0 CA-C-N 118.006 0.366 . . . . 0.0 111.329 -176.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -99.05 7.46 60.47 Favored Glycine 0 C--N 1.354 1.57 0 C-N-CA 123.338 0.494 . . . . 0.0 113.626 178.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . . . . . . . . . 97.8 m95 -133.7 141.1 38.78 Favored Pre-proline 0 N--CA 1.486 1.374 0 C-N-CA 123.639 0.776 . . . . 0.0 109.529 172.921 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 34.4 Cg_endo -62.84 159.32 38.28 Favored 'Trans proline' 0 CA--C 1.565 2.031 0 C-N-CA 122.214 1.943 . . . . 0.0 110.717 168.287 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 59.4 Cg_endo -68.22 0.56 4.41 Favored 'Trans proline' 0 C--N 1.384 2.396 0 C-N-CA 123.083 2.522 . . . . 0.0 114.221 -174.018 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -77.09 -14.56 59.79 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 123.237 0.615 . . . . 0.0 111.562 170.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 34.1 m-85 -119.27 7.25 11.24 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.663 0.785 . . . . 0.0 111.052 179.114 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 62.4 p -69.27 122.58 19.16 Favored 'General case' 0 N--CA 1.478 0.949 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 28.9 p -101.44 143.71 31.13 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.329 0.652 . . . . 0.0 111.314 -173.623 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 91.7 m95 -76.82 86.35 3.41 Favored 'General case' 0 N--CA 1.475 0.794 0 N-CA-C 109.562 -0.533 . . . . 0.0 109.562 174.767 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 71.7 mm-40 -94.5 113.08 60.1 Favored Pre-proline 0 N--CA 1.472 0.632 0 N-CA-C 108.895 -0.78 . . . . 0.0 108.895 174.874 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.409 ' HA ' ' HA ' ' A' ' 21' ' ' GLU . 36.7 Cg_endo -64.71 172.48 6.86 Favored 'Trans proline' 0 C--N 1.371 1.728 0 C-N-CA 121.787 1.658 . . . . 0.0 113.616 175.703 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . 0.517 ' HG3' ' HG3' ' A' ' 40' ' ' GLU . 11.4 pt-20 -43.75 -41.86 5.14 Favored 'General case' 0 N--CA 1.486 1.366 0 C-N-CA 126.696 1.998 . . . . 0.0 114.156 -179.198 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . 0.517 ' HG3' ' HG3' ' A' ' 39' ' ' GLU . 24.2 mt-10 -75.09 -29.57 60.68 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 124.694 1.198 . . . . 0.0 111.015 -176.588 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.472 ' CD2' ' HA ' ' B' ' 28' ' ' SER . 2.2 m80 -86.46 -2.96 58.9 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.405 1.082 . . . . 0.0 112.858 -172.171 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 48.4 mm -99.87 149.73 5.7 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.299 0 C-N-CA 124.889 1.276 . . . . 0.0 110.471 -178.897 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.555 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 30.5 mt -81.98 -77.62 0.22 Allowed 'General case' 0 C--N 1.358 0.942 0 N-CA-C 109.554 -0.536 . . . . 0.0 109.554 167.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.1 t0 -68.31 110.53 5.89 Favored Pre-proline 0 C--N 1.362 1.12 0 N-CA-C 109.514 -0.55 . . . . 0.0 109.514 -170.357 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -71.68 -22.7 23.75 Favored 'Trans proline' 0 C--N 1.377 2.071 0 C-N-CA 122.425 2.083 . . . . 0.0 112.076 -177.068 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.3 mtm180 -70.81 -14.83 62.56 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.597 0.759 . . . . 0.0 111.443 -177.814 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 42.6 mt -57.29 -46.51 83.08 Favored 'General case' 0 N--CA 1.49 1.568 0 C-N-CA 123.713 0.805 . . . . 0.0 111.227 170.846 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 95.2 t -63.05 -53.18 49.7 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.512 0 CA-C-N 114.697 -1.138 . . . . 0.0 109.754 179.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.463 ' O ' ' HG3' ' A' ' 53' ' ' GLU . 1.3 mpt? -57.77 -38.5 75.53 Favored 'General case' 0 N--CA 1.478 0.965 0 O-C-N 124.23 0.956 . . . . 0.0 111.141 178.884 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.44 -42.4 99.43 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.956 0.902 . . . . 0.0 110.74 -179.541 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 81.7 t80 -63.84 -42.24 97.64 Favored 'General case' 0 CA--C 1.552 1.02 0 C-N-CA 124.175 0.99 . . . . 0.0 110.391 174.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.641 ' HA ' ' HB2' ' A' ' 55' ' ' GLU . 59.0 mt-10 -76.12 -10.44 59.41 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.758 0.823 . . . . 0.0 112.953 -174.487 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.463 ' HG3' ' O ' ' A' ' 49' ' ' MET . 52.0 mt-10 -65.1 -29.94 70.84 Favored 'General case' 0 N--CA 1.489 1.523 0 C-N-CA 122.473 0.309 . . . . 0.0 110.967 172.904 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.64 30.94 3.73 Favored 'General case' 0 CA--C 1.543 0.686 0 C-N-CA 123.671 0.788 . . . . 0.0 110.24 -177.234 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.641 ' HB2' ' HA ' ' A' ' 52' ' ' GLU . 39.2 tt0 -74.25 88.28 2.0 Allowed 'General case' 0 CA--C 1.544 0.742 0 N-CA-C 109.365 -0.605 . . . . 0.0 109.365 176.624 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.9 pt-20 . . . . . 0 CA--C 1.558 1.256 0 C-N-CA 124.443 1.097 . . . . 0.0 108.84 -178.137 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 11.9 pt20 . . . . . 0 N--CA 1.491 1.623 0 CA-C-O 120.973 0.416 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 62.1 mt -72.19 -34.66 68.57 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.804 0.842 . . . . 0.0 110.72 179.354 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -92.04 130.52 37.76 Favored 'General case' 0 N--CA 1.476 0.862 0 C-N-CA 123.299 0.639 . . . . 0.0 109.689 176.977 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 11.9 t -94.84 5.19 52.61 Favored 'General case' 0 N--CA 1.483 1.202 0 C-N-CA 123.888 0.875 . . . . 0.0 111.833 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 27.7 mtpp -50.92 142.69 11.35 Favored 'General case' 0 N--CA 1.491 1.577 0 C-N-CA 124.969 1.308 . . . . 0.0 111.905 -175.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -109.63 116.23 31.35 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 122.925 0.49 . . . . 0.0 110.42 -176.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.462 ' HB2' HG11 ' A' ' 7' ' ' VAL . . . -94.54 -173.33 3.0 Favored 'General case' 0 C--O 1.246 0.903 0 N-CA-C 108.027 -1.101 . . . . 0.0 108.027 167.246 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.555 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 15.3 ttt180 -153.06 146.1 24.6 Favored 'General case' 0 C--N 1.323 -0.581 0 CA-C-N 115.54 -0.754 . . . . 0.0 109.26 -176.127 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--N 1.323 -0.553 0 N-CA-C 107.689 -1.226 . . . . 0.0 107.689 166.918 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.472 ' HA ' ' CD2' ' A' ' 41' ' ' HIS . 51.1 m 94.4 158.17 0.03 OUTLIER 'General case' 0 N--CA 1.476 0.834 0 C-N-CA 125.512 1.525 . . . . 0.0 111.679 170.323 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -67.42 153.31 95.08 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 123.959 0.904 . . . . 0.0 112.391 -172.455 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 71.6 Cg_exo -52.04 117.11 3.26 Favored 'Trans proline' 0 C--N 1.379 2.143 0 C-N-CA 123.353 2.702 . . . . 0.0 112.853 173.662 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -85.64 89.45 7.73 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.636 0.774 . . . . 0.0 109.964 -178.4 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 23.8 m -73.19 130.31 39.97 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.54 0.736 . . . . 0.0 111.256 -176.645 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.535 1.317 0 CA-C-O 119.343 -0.698 . . . . 0.0 113.816 -177.842 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.445 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -85.42 164.06 18.12 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.319 0.648 . . . . 0.0 109.683 -178.885 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 10.1 tt0 -89.47 104.14 16.72 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 123.513 0.725 . . . . 0.0 111.603 -166.749 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 21.9 t -119.79 139.73 46.16 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.504 1.122 . . . . 0.0 108.611 178.465 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 71.6 m-85 -137.79 167.61 21.37 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 123.644 0.777 . . . . 0.0 109.989 175.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.06 124.5 25.09 Favored 'General case' 0 C--O 1.248 0.974 0 CA-C-N 115.175 -0.92 . . . . 0.0 108.519 171.275 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.445 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 3.0 p -110.25 145.29 16.92 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.827 0 C-N-CA 123.655 0.782 . . . . 0.0 110.534 -177.587 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 42.3 tt0 -90.0 -46.12 8.72 Favored 'General case' 0 CA--C 1.543 0.679 0 C-N-CA 124.27 1.028 . . . . 0.0 110.763 179.974 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 52.4 p -175.46 -170.12 0.4 Allowed 'General case' 0 N--CA 1.478 0.958 0 C-N-CA 123.487 0.715 . . . . 0.0 110.663 -172.254 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.452 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.3 mm -111.79 120.98 63.44 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.691 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 168.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.423 ' HB3' HD23 ' A' ' 23' ' ' LEU . 0.4 OUTLIER -74.31 -56.25 5.09 Favored 'General case' 0 CA--C 1.551 1.003 0 C-N-CA 124.077 0.951 . . . . 0.0 109.677 -179.313 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.468 ' H ' ' HB3' ' A' ' 23' ' ' LEU . 33.6 mtmm -137.61 176.52 8.63 Favored 'General case' 0 N--CA 1.49 1.573 0 C-N-CA 123.962 0.905 . . . . 0.0 111.066 -179.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.8 tttt -156.99 152.53 26.73 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.756 1.222 . . . . 0.0 108.448 -173.157 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 37.8 ptt180 -165.7 164.15 19.0 Favored 'General case' 0 N--CA 1.47 0.538 0 C-N-CA 123.452 0.701 . . . . 0.0 109.723 177.216 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.481 HG22 HG22 ' A' ' 20' ' ' VAL . 38.6 t -108.87 126.92 65.82 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.4 0 N-CA-C 106.709 -1.589 . . . . 0.0 106.709 166.2 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -139.0 105.77 5.38 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.413 1.085 . . . . 0.0 108.94 -170.334 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 14.3 mmmm 62.26 26.86 16.11 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.375 1.07 . . . . 0.0 111.623 -176.278 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 93.08 -15.46 62.83 Favored Glycine 0 C--N 1.348 1.205 0 CA-C-N 115.733 -0.667 . . . . 0.0 113.175 -176.215 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.2 mmtt -84.08 110.94 18.87 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.257 0.623 . . . . 0.0 110.009 178.631 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.481 HG22 HG22 ' A' ' 15' ' ' VAL . 43.7 t -76.21 104.47 4.35 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.495 0 N-CA-C 107.65 -1.241 . . . . 0.0 107.65 175.751 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 66.3 mt-10 -98.62 149.29 22.93 Favored 'General case' 0 C--N 1.343 0.324 0 C-N-CA 123.527 0.731 . . . . 0.0 110.679 -176.014 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.452 ' HB3' HD12 ' A' ' 10' ' ' ILE . 92.8 m-85 -125.7 119.0 26.81 Favored 'General case' 0 C--N 1.33 -0.262 0 CA-C-N 114.846 -1.07 . . . . 0.0 108.175 179.756 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . 0.468 ' HB3' ' H ' ' A' ' 12' ' ' LYS . 36.4 tp -70.12 86.71 0.56 Allowed 'General case' 0 C--O 1.237 0.399 0 N-CA-C 107.698 -1.223 . . . . 0.0 107.698 170.028 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.425 HG21 HD11 ' A' ' 42' ' ' ILE . 75.7 t -70.63 107.35 2.02 Favored 'Isoleucine or valine' 0 CA--C 1.531 0.229 0 CA-C-N 114.932 -1.031 . . . . 0.0 110.106 -173.261 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 25.8 tptp -79.79 102.07 8.85 Favored 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.785 -0.82 . . . . 0.0 108.785 177.641 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.544 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 71.0 m95 -77.28 154.27 33.1 Favored 'General case' 0 N--CA 1.468 0.46 0 CA-C-N 115.992 -0.549 . . . . 0.0 110.648 -177.399 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 23.2 ttmm -76.74 -33.25 58.13 Favored 'General case' 0 CA--C 1.545 0.762 0 C-N-CA 123.419 0.687 . . . . 0.0 109.662 176.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -89.26 -25.51 28.42 Favored Glycine 0 C--N 1.352 1.427 0 CA-C-N 115.529 -0.759 . . . . 0.0 113.414 -179.471 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.544 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 97.6 m95 -106.54 135.22 19.53 Favored Pre-proline 0 N--CA 1.481 1.082 0 CA-C-N 117.338 0.569 . . . . 0.0 111.424 -176.564 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 78.7 Cg_exo -53.98 158.76 8.38 Favored 'Trans proline' 0 C--N 1.385 2.498 0 C-N-CA 123.461 2.774 . . . . 0.0 113.098 170.71 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 41.2 Cg_endo -63.68 -16.81 56.96 Favored 'Trans proline' 0 C--N 1.382 2.301 0 C-N-CA 123.225 2.617 . . . . 0.0 113.621 -176.959 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.6 ptpt -79.95 -36.72 35.77 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 122.884 0.474 . . . . 0.0 110.858 173.304 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . . . . . . . . . 78.2 m-85 -83.6 -5.76 59.26 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 123.322 0.649 . . . . 0.0 111.37 177.552 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 49.8 m -66.58 134.73 52.95 Favored 'General case' 0 CA--C 1.543 0.688 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 169.913 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.7 p -120.4 159.27 25.44 Favored 'General case' 0 N--CA 1.479 1.011 0 C-N-CA 123.295 0.638 . . . . 0.0 111.824 -169.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.02 84.51 6.95 Favored 'General case' 0 N--CA 1.474 0.736 0 C-N-CA 123.928 0.891 . . . . 0.0 110.464 179.98 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 31.5 mm-40 -101.34 111.79 64.16 Favored Pre-proline 0 CA--C 1.536 0.408 0 CA-C-N 115.454 -0.794 . . . . 0.0 109.44 177.121 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 30.4 Cg_endo -61.57 165.51 13.33 Favored 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 122.135 1.89 . . . . 0.0 112.326 172.36 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 9.5 pt-20 -60.16 -21.45 61.67 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 124.216 1.007 . . . . 0.0 112.734 -178.462 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -60.38 -33.04 71.89 Favored 'General case' 0 N--CA 1.49 1.526 0 C-N-CA 124.249 1.02 . . . . 0.0 111.017 173.821 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.628 ' HA ' ' HB3' ' B' ' 28' ' ' SER . 2.0 m80 -83.26 -29.88 28.07 Favored 'General case' 0 CA--C 1.537 0.474 0 CA-C-N 114.551 -1.204 . . . . 0.0 111.538 -175.632 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.481 HD12 ' HB1' ' B' ' 25' ' ' ALA . 40.1 mm -88.83 144.87 8.22 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.542 0 C-N-CA 123.936 0.895 . . . . 0.0 111.949 -165.817 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . . . . . . . . . 93.0 mt -85.31 -72.79 0.47 Allowed 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 123.426 0.69 . . . . 0.0 111.061 178.374 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 16.7 t70 -75.09 131.99 77.66 Favored Pre-proline 0 CA--C 1.556 1.203 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 -176.153 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 83.8 Cg_endo -78.53 -18.63 12.05 Favored 'Trans proline' 0 C--N 1.376 2.022 0 C-N-CA 122.666 2.244 . . . . 0.0 114.027 -177.95 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 69.8 mtm180 -71.71 -13.19 61.65 Favored 'General case' 0 N--CA 1.484 1.229 0 N-CA-C 113.657 0.984 . . . . 0.0 113.657 -172.03 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . 0.434 HD11 HG13 ' A' ' 7' ' ' VAL . 2.6 mm? -61.6 -47.38 85.7 Favored 'General case' 0 N--CA 1.481 1.118 0 N-CA-C 109.569 -0.53 . . . . 0.0 109.569 168.223 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . 0.482 ' O ' ' HG2' ' A' ' 52' ' ' GLU . 91.5 t -64.21 -46.54 93.13 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.729 0 CA-C-N 115.298 -0.865 . . . . 0.0 109.649 176.895 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 31.2 mmt -57.82 -39.71 78.25 Favored 'General case' 0 N--CA 1.487 1.411 0 C-N-CA 123.674 0.789 . . . . 0.0 111.566 -178.093 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -60.03 -39.25 85.24 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 124.201 1.0 . . . . 0.0 110.885 177.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.416 ' HB2' ' HB ' ' A' ' 10' ' ' ILE . 68.1 t80 -73.14 -35.98 66.6 Favored 'General case' 0 CA--C 1.553 1.083 0 CA-C-N 114.8 -1.091 . . . . 0.0 110.716 178.583 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.482 ' HG2' ' O ' ' A' ' 48' ' ' VAL . 35.9 mm-40 -69.86 -13.1 62.1 Favored 'General case' 0 N--CA 1.486 1.328 0 C-N-CA 123.193 0.597 . . . . 0.0 112.271 -175.527 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 43.7 mt-10 -71.84 -9.05 57.76 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.583 0.753 . . . . 0.0 112.784 179.085 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -129.67 174.95 9.22 Favored 'General case' 0 N--CA 1.476 0.855 0 C-N-CA 124.539 1.136 . . . . 0.0 109.733 173.94 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 54.0 22.72 3.57 Favored 'General case' 0 N--CA 1.508 2.465 0 C-N-CA 126.451 1.9 . . . . 0.0 111.832 -166.061 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 12.8 pt-20 . . . . . 0 CA--C 1.562 1.425 0 C-N-CA 125.064 1.346 . . . . 0.0 111.845 -171.526 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 . . . . . 0 N--CA 1.481 1.103 0 N-CA-C 109.738 -0.467 . . . . 0.0 109.738 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 92.5 mt -122.43 97.94 5.7 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.009 -1.108 . . . . 0.0 108.009 173.73 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -78.77 154.09 30.25 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.146 0.578 . . . . 0.0 110.046 176.399 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 14.3 t -130.61 25.34 5.08 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.785 0.834 . . . . 0.0 109.444 -179.82 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 26.5 mmmt -78.07 -174.76 3.76 Favored 'General case' 0 C--O 1.25 1.109 0 CA-C-N 115.257 -0.883 . . . . 0.0 111.598 -173.286 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -108.82 108.02 18.67 Favored 'General case' 0 N--CA 1.462 0.159 0 CA-C-N 115.725 -0.67 . . . . 0.0 109.804 177.225 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.481 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -97.06 155.42 16.81 Favored 'General case' 0 C--O 1.242 0.666 0 N-CA-C 106.849 -1.537 . . . . 0.0 106.849 163.027 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.647 ' HE ' ' HB2' ' B' ' 28' ' ' SER . 7.5 ttt180 -141.45 154.24 45.45 Favored 'General case' 0 C--N 1.321 -0.666 0 N-CA-C 109.309 -0.626 . . . . 0.0 109.309 -169.6 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.405 ' HE2' ' CZ2' ' A' ' 26' ' ' TRP . . . . . . . . 0 C--O 1.238 0.471 0 C-N-CA 124.635 1.174 . . . . 0.0 108.451 176.617 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . 0.647 ' HB2' ' HE ' ' B' ' 26' ' ' ARG . 8.6 t -72.25 83.02 1.03 Allowed 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.45 -0.795 . . . . 0.0 109.011 175.833 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -59.04 140.95 86.86 Favored Pre-proline 0 CA--C 1.547 0.834 0 C-N-CA 124.274 1.029 . . . . 0.0 111.381 -176.028 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 89.3 Cg_endo -74.04 -7.57 20.05 Favored 'Trans proline' 0 C--N 1.375 1.937 0 C-N-CA 122.348 2.032 . . . . 0.0 112.967 -174.862 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . 65.88 -72.06 0.08 Allowed 'General case' 0 C--N 1.36 1.042 0 C-N-CA 125.442 1.497 . . . . 0.0 111.354 179.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 15.4 t -72.9 141.15 47.88 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.335 0.654 . . . . 0.0 110.125 173.344 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.534 1.241 0 N-CA-C 110.752 -0.939 . . . . 0.0 110.752 -176.335 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.937 0 N-CA-C 112.102 -0.399 . . . . 0.0 112.102 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.494 ' HG3' ' HD2' ' B' ' 26' ' ' ARG . 0.0 OUTLIER -153.65 -171.68 3.98 Favored 'General case' 0 N--CA 1.476 0.832 0 C-N-CA 123.505 0.722 . . . . 0.0 109.6 177.752 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . 0.433 ' HB2' ' HB3' ' B' ' 27' ' ' M3L . 1.7 mp0 -81.39 82.19 7.29 Favored 'General case' 0 CA--C 1.548 0.887 0 C-N-CA 123.679 0.792 . . . . 0.0 111.084 -172.652 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 77.5 t -112.47 124.84 69.54 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.859 0 C-N-CA 124.389 1.076 . . . . 0.0 108.345 172.927 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . 0.484 ' HE2' HM23 ' B' ' 27' ' ' M3L . 94.4 m-85 -135.23 162.29 32.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.7 0.8 . . . . 0.0 109.623 178.078 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.91 107.06 5.09 Favored 'General case' 0 C--O 1.241 0.644 0 C-N-CA 123.448 0.699 . . . . 0.0 109.197 175.381 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . 0.523 ' HA ' ' HA ' ' A' ' 26' ' ' TRP . 4.1 p -85.43 135.0 25.84 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 CA-C-N 115.419 -0.81 . . . . 0.0 110.09 -179.658 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . 0.512 ' HB2' ' HA ' ' A' ' 27' ' ' LYS . 12.8 tp10 -69.11 -50.4 48.44 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.157 0.583 . . . . 0.0 109.758 175.031 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 15.8 p 178.76 -175.89 0.22 Allowed 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 125.526 1.53 . . . . 0.0 108.853 -179.152 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . 0.516 HD12 ' HB3' ' A' ' 22' ' ' TYR . 50.5 mm -85.62 122.77 38.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.618 0 N-CA-C 108.816 -0.809 . . . . 0.0 108.816 174.05 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.604 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.5 tmt_? -67.82 -56.05 10.63 Favored 'General case' 0 CA--C 1.548 0.89 0 C-N-CA 124.337 1.055 . . . . 0.0 109.194 178.041 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.427 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 98.8 mttt -140.81 157.92 44.7 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.116 -176.984 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 56.1 tttt -139.32 143.67 37.95 Favored 'General case' 0 C--O 1.239 0.527 0 C-N-CA 124.847 1.259 . . . . 0.0 108.269 178.137 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -169.04 138.1 2.1 Favored 'General case' 0 N--CA 1.474 0.77 0 O-C-N 123.902 0.751 . . . . 0.0 109.924 176.314 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . . . . . . . . . 7.4 p -86.16 124.28 40.17 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.95 0 N-CA-C 109.252 -0.647 . . . . 0.0 109.252 178.196 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 55.0 ttp180 -127.07 105.2 8.42 Favored 'General case' 0 CA--C 1.537 0.454 0 C-N-CA 124.483 1.113 . . . . 0.0 109.156 -173.189 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.9 OUTLIER 59.51 32.95 22.01 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 124.57 1.148 . . . . 0.0 111.087 -179.582 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 86.92 2.65 83.85 Favored Glycine 0 C--N 1.349 1.305 0 CA-C-N 115.893 -0.594 . . . . 0.0 113.588 179.481 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.515 ' HE3' ' HA ' ' A' ' 19' ' ' LYS . 0.0 OUTLIER -107.14 111.63 24.14 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.444 0.698 . . . . 0.0 109.827 174.627 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . . . . . . . . . 32.5 t -74.18 110.52 8.35 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.451 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 68.9 mm-40 -93.7 144.04 25.76 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 124.156 0.982 . . . . 0.0 109.386 -173.493 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . 0.516 ' HB3' HD12 ' A' ' 10' ' ' ILE . 94.6 m-85 -128.86 109.36 11.2 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.617 0.767 . . . . 0.0 109.097 176.878 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 35.8 tp -67.36 97.11 0.54 Allowed 'General case' 0 C--N 1.345 0.388 0 N-CA-C 107.752 -1.203 . . . . 0.0 107.752 168.467 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 46.1 t -76.47 105.93 5.86 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 C-N-CA 123.768 0.827 . . . . 0.0 110.131 -173.798 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.604 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.1 tptp -82.24 100.12 9.7 Favored 'General case' 0 C--O 1.238 0.459 0 N-CA-C 109.046 -0.724 . . . . 0.0 109.046 179.034 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.657 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 46.2 m95 -69.04 140.64 54.94 Favored 'General case' 0 C--O 1.237 0.414 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 174.6 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . 0.512 ' HA ' ' HB2' ' A' ' 8' ' ' GLU . 36.8 ttpt -59.98 -50.84 72.16 Favored 'General case' 0 N--CA 1.475 0.814 0 O-C-N 123.585 0.553 . . . . 0.0 111.874 -172.038 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -84.85 -28.41 31.81 Favored Glycine 0 C--N 1.341 0.819 0 CA-C-N 115.921 -0.581 . . . . 0.0 113.343 -177.784 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.657 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 58.1 m95 -89.26 123.83 66.12 Favored Pre-proline 0 CA--C 1.553 1.072 0 C-N-CA 122.713 0.405 . . . . 0.0 110.147 -175.318 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . 0.481 ' HB2' ' HG2' ' A' ' 32' ' ' LYS . 72.4 Cg_exo -53.76 164.92 2.05 Favored 'Trans proline' 0 C--N 1.38 2.205 0 C-N-CA 123.645 2.897 . . . . 0.0 113.979 174.749 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 53.4 Cg_exo -54.75 -23.56 33.96 Favored 'Trans proline' 0 C--N 1.387 2.584 0 C-N-CA 123.674 2.916 . . . . 0.0 114.855 -179.156 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . 0.481 ' HG2' ' HB2' ' A' ' 30' ' ' PRO . 55.4 pttt -66.3 -33.0 74.76 Favored 'General case' 0 N--CA 1.483 1.197 0 C-N-CA 123.227 0.611 . . . . 0.0 112.124 176.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.468 ' HB2' ' HB3' ' A' ' 29' ' ' TRP . 75.0 m-85 -91.35 -13.39 32.6 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.274 0.63 . . . . 0.0 111.544 176.555 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 39.8 m -66.92 130.77 44.23 Favored 'General case' 0 CA--C 1.542 0.664 0 N-CA-C 108.946 -0.761 . . . . 0.0 108.946 173.338 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 33.0 p -119.47 145.04 46.64 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.477 0.711 . . . . 0.0 111.164 -171.624 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 94.8 m95 -76.2 79.51 3.0 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 123.575 0.75 . . . . 0.0 110.252 178.913 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 63.5 mm-40 -93.18 113.67 60.64 Favored Pre-proline 0 C--O 1.236 0.373 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 175.47 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . . . . . . . . . 50.1 Cg_endo -69.59 178.5 4.41 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 121.595 1.53 . . . . 0.0 113.271 -178.967 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 11.6 pt-20 -38.18 -42.71 0.7 Allowed 'General case' 0 CA--C 1.555 1.17 0 C-N-CA 127.186 2.194 . . . . 0.0 115.214 177.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 10.2 tp10 -77.91 -20.67 52.44 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 123.517 0.727 . . . . 0.0 111.995 -173.398 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . . . . . . . . . 72.7 m-70 -112.73 16.78 19.5 Favored 'General case' 0 C--O 1.253 1.276 0 N-CA-C 113.673 0.99 . . . . 0.0 113.673 -164.809 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . . . . . . . . . 32.3 mm -101.69 152.64 5.28 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.265 0 C-N-CA 125.474 1.51 . . . . 0.0 109.213 172.92 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.41 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 91.1 mt -83.45 -73.89 0.39 Allowed 'General case' 0 N--CA 1.483 1.176 0 CA-C-N 118.08 0.4 . . . . 0.0 110.817 176.094 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 7.5 t70 -75.79 118.3 70.02 Favored Pre-proline 0 CA--C 1.555 1.16 0 N-CA-C 108.324 -0.991 . . . . 0.0 108.324 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -72.0 -19.92 26.07 Favored 'Trans proline' 0 C--N 1.37 1.661 0 C-N-CA 122.557 2.171 . . . . 0.0 112.724 -176.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -71.82 -10.08 59.25 Favored 'General case' 0 CA--C 1.548 0.902 0 CA-C-O 118.194 -0.908 . . . . 0.0 112.326 178.131 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 2.3 mm? -49.14 -42.04 38.25 Favored 'General case' 0 N--CA 1.507 2.392 0 CA-C-N 119.248 0.931 . . . . 0.0 110.412 167.489 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 36.4 t -66.25 -51.57 57.51 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.858 0 CA-C-N 114.911 -1.04 . . . . 0.0 109.918 -179.654 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . . . . . . . . . 24.4 mmt -55.27 -42.36 73.46 Favored 'General case' 0 N--CA 1.497 1.889 0 C-N-CA 123.856 0.862 . . . . 0.0 111.49 177.838 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . 0.47 ' HB1' ' O ' ' B' ' 19' ' ' GLN . . . -66.65 -39.43 88.22 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 124.871 1.268 . . . . 0.0 111.339 -175.892 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . . . . . . . . . 55.8 t80 -74.68 -46.76 35.76 Favored 'General case' 0 CA--C 1.543 0.709 0 CA-C-N 114.936 -1.029 . . . . 0.0 111.47 -179.304 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . 0.417 ' HA ' ' HG2' ' A' ' 55' ' ' GLU . 62.5 mt-10 -68.71 -6.3 25.46 Favored 'General case' 0 N--CA 1.485 1.294 0 C-N-CA 123.449 0.7 . . . . 0.0 112.793 -170.957 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . . . . . . . . . 63.0 mm-40 -63.08 -18.14 63.06 Favored 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.524 0.73 . . . . 0.0 112.006 168.78 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 55.6 mtpt -79.87 -49.77 11.46 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 123.221 0.608 . . . . 0.0 110.324 177.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . 0.417 ' HG2' ' HA ' ' A' ' 52' ' ' GLU . 11.9 pt-20 -77.89 159.8 28.67 Favored 'General case' 0 N--CA 1.48 1.056 0 C-N-CA 123.258 0.623 . . . . 0.0 110.101 177.144 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 38.2 mt-10 . . . . . 0 C--O 1.248 1.005 0 CA-C-O 118.549 -0.738 . . . . 0.0 109.408 -177.284 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . 0.47 ' O ' ' HB1' ' A' ' 50' ' ' ALA . 58.8 tp60 . . . . . 0 N--CA 1.484 1.269 0 N-CA-C 110.194 -0.299 . . . . 0.0 110.194 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 42.1 mt -69.62 104.23 2.32 Favored 'General case' 0 C--N 1.353 0.747 0 N-CA-C 107.54 -1.281 . . . . 0.0 107.54 171.167 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . 0.434 ' O ' ' HG3' ' B' ' 23' ' ' LYS . . . -134.3 140.87 46.7 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.093 0.957 . . . . 0.0 109.611 -174.672 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 52.4 p -75.46 106.89 7.24 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 123.65 0.78 . . . . 0.0 110.571 -175.336 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . 0.434 ' HG3' ' O ' ' B' ' 21' ' ' ALA . 22.8 mtpp -118.21 -165.92 1.16 Allowed 'General case' 0 N--CA 1.48 1.046 0 C-N-CA 124.389 1.076 . . . . 0.0 110.081 -174.123 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -115.18 125.77 53.8 Favored 'General case' 0 N--CA 1.465 0.306 0 C-N-CA 123.31 0.644 . . . . 0.0 110.117 174.202 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . . . . . . . . . . . -131.59 175.51 9.1 Favored 'General case' 0 C--O 1.245 0.862 0 C-N-CA 124.189 0.996 . . . . 0.0 108.508 171.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.494 ' HD2' ' HG3' ' A' ' 2' ' ' GLU . 45.0 ttp180 -144.85 150.1 36.53 Favored 'General case' 0 C--O 1.235 0.315 0 C-N-CA 123.065 0.546 . . . . 0.0 110.706 -173.455 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . 0.484 HM23 ' HE2' ' A' ' 5' ' ' PHE . . . . . . . . 0 C--O 1.241 0.652 0 N-CA-C 107.478 -1.304 . . . . 0.0 107.478 165.236 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 42.3 t -76.78 82.95 3.38 Favored 'General case' 0 CA--C 1.549 0.917 0 N-CA-C 108.977 -0.749 . . . . 0.0 108.977 176.541 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -69.93 142.69 90.97 Favored Pre-proline 0 CA--C 1.549 0.926 0 CA-C-N 114.854 -1.066 . . . . 0.0 112.029 -171.386 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -72.96 156.88 52.0 Favored 'Trans proline' 0 C--N 1.378 2.123 0 C-N-CA 122.662 2.241 . . . . 0.0 112.308 177.136 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -81.3 -54.51 5.42 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.283 0.633 . . . . 0.0 109.46 175.573 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 44.3 p -124.82 -32.19 3.09 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 124.489 1.115 . . . . 0.0 110.218 177.991 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 1.528 0 CA-C-O 118.866 -0.963 . . . . 0.0 112.67 -173.525 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.597 0 N-CA-C 112.138 -0.385 . . . . 0.0 112.138 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.7 tt0 -87.99 134.29 33.76 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 124.234 1.014 . . . . 0.0 109.453 -172.793 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' GLN . . . . . . . . . . . . . 6.7 tp-100 -64.33 116.79 6.4 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 124.343 1.057 . . . . 0.0 113.196 -163.038 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 61.3 t -116.67 140.8 37.48 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.83 0 C-N-CA 124.963 1.305 . . . . 0.0 108.584 175.259 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' PHE . . . . . . . . . . . . . 21.5 m-85 -141.31 158.63 43.63 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.53 0.732 . . . . 0.0 110.373 171.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' ALA . . . . . . . . . . . . . . . -72.75 114.87 11.36 Favored 'General case' 0 C--O 1.243 0.758 0 CA-C-N 114.851 -1.068 . . . . 0.0 108.588 169.836 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' VAL . . . . . . . . . . . . . 2.4 p -87.27 138.76 18.46 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.518 0 C-N-CA 124.345 1.058 . . . . 0.0 110.249 -177.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' GLU . . . . . . . . . . . . . 41.2 tt0 -76.28 -57.4 3.89 Favored 'General case' 0 C--O 1.244 0.791 0 C-N-CA 122.922 0.489 . . . . 0.0 109.821 175.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 37.0 m -157.16 170.95 21.33 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 124.013 0.925 . . . . 0.0 110.16 -177.473 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ILE . . . . . . . . . . . . . 45.2 mm -89.28 110.9 22.14 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.521 0 N-CA-C 106.921 -1.511 . . . . 0.0 106.921 162.992 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.516 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 1.6 tmt_? -66.37 -58.46 5.25 Favored 'General case' 0 CA--C 1.552 1.049 0 C-N-CA 124.348 1.059 . . . . 0.0 109.198 -177.846 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' LYS . . . . . 0.492 ' HG3' ' HD2' ' A' ' 11' ' ' ARG . 27.5 mtpp -137.58 170.88 15.31 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 123.774 0.83 . . . . 0.0 111.444 -177.68 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' LYS . . . . . . . . . . . . . 84.9 tttt -156.68 129.4 7.7 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 124.432 1.093 . . . . 0.0 108.898 -174.955 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' ARG . . . . . . . . . . . . . 17.0 ptm180 -157.84 150.72 22.94 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 123.682 0.793 . . . . 0.0 109.235 178.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 20' ' ' VAL . 47.2 t -93.43 112.68 26.9 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 N-CA-C 108.515 -0.92 . . . . 0.0 108.515 173.341 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 36.1 ttp180 -107.2 96.83 6.7 Favored 'General case' 0 CA--C 1.541 0.621 0 C-N-CA 124.761 1.224 . . . . 0.0 108.751 179.407 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 53.3 tptt 62.11 49.28 4.55 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.645 1.178 . . . . 0.0 110.938 176.932 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . 81.82 -18.28 12.94 Favored Glycine 0 CA--C 1.538 1.513 0 CA-C-N 115.479 -0.782 . . . . 0.0 113.677 179.851 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 2.6 mmmp? -86.68 110.54 19.94 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 124.005 0.922 . . . . 0.0 109.57 177.848 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' VAL . . . . . 0.455 HG22 HG22 ' A' ' 15' ' ' VAL . 21.4 t -78.71 103.75 5.99 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 108.338 -0.986 . . . . 0.0 108.338 -179.753 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 12.1 mm-40 -98.41 144.95 27.22 Favored 'General case' 0 N--CA 1.476 0.854 0 C-N-CA 124.235 1.014 . . . . 0.0 110.554 -173.546 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' TYR . . . . . . . . . . . . . 78.6 m-85 -126.32 119.92 28.59 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 124.089 0.956 . . . . 0.0 108.602 -179.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LEU . . . . . . . . . . . . . 28.3 tp -70.72 90.81 0.79 Allowed 'General case' 0 C--O 1.223 -0.339 0 N-CA-C 107.076 -1.453 . . . . 0.0 107.076 169.615 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.531 HG21 HD11 ' A' ' 42' ' ' ILE . 63.7 t -78.02 105.26 6.85 Favored 'Isoleucine or valine' 0 C--O 1.238 0.485 0 C-N-CA 123.697 0.799 . . . . 0.0 109.95 -173.545 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.516 ' HB2' ' HB2' ' A' ' 11' ' ' ARG . 27.4 tptp -77.41 103.55 7.4 Favored 'General case' 0 CA--C 1.534 0.362 0 C-N-CA 123.45 0.7 . . . . 0.0 109.14 179.684 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' TRP . . . . . 0.498 ' HB2' ' HB2' ' A' ' 29' ' ' TRP . 60.2 m95 -77.04 157.32 31.2 Favored 'General case' 0 N--CA 1.469 0.485 0 C-N-CA 123.49 0.716 . . . . 0.0 110.111 179.658 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' LYS . . . . . . . . . . . . . 40.6 ttmt -64.55 -41.98 95.98 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 122.931 0.492 . . . . 0.0 111.098 179.457 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' GLY . . . . . . . . . . . . . . . -88.0 -24.39 35.08 Favored Glycine 0 C--N 1.346 1.098 0 CA-C-N 115.935 -0.575 . . . . 0.0 113.597 -177.152 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' TRP . . . . . 0.498 ' HB2' ' HB2' ' A' ' 26' ' ' TRP . 77.0 m95 -104.45 124.59 36.67 Favored Pre-proline 0 CA--C 1.551 0.988 0 C-N-CA 122.906 0.482 . . . . 0.0 111.055 -172.448 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' PRO . . . . . . . . . . . . . 74.2 Cg_exo -52.98 163.66 1.99 Allowed 'Trans proline' 0 C--N 1.386 2.524 0 C-N-CA 124.056 3.17 . . . . 0.0 113.363 171.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' PRO . . . . . . . . . . . . . 42.6 Cg_endo -62.84 -26.64 74.77 Favored 'Trans proline' 0 C--N 1.385 2.497 0 C-N-CA 123.08 2.52 . . . . 0.0 113.448 -174.827 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' LYS . . . . . . . . . . . . . 18.4 ptpt -78.47 -26.25 46.03 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.069 0.548 . . . . 0.0 111.278 175.645 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' TYR . . . . . 0.402 ' HB3' ' HE3' ' A' ' 29' ' ' TRP . 87.3 m-85 -92.75 2.11 56.92 Favored 'General case' 0 N--CA 1.487 1.378 0 C-N-CA 123.838 0.855 . . . . 0.0 111.391 175.041 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' SER . . . . . . . . . . . . . 66.0 m -76.3 155.73 34.0 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.369 0.667 . . . . 0.0 110.347 176.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' THR . . . . . . . . . . . . . 23.3 p -115.35 135.43 54.14 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.258 0.623 . . . . 0.0 112.481 -171.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' TRP . . . . . . . . . . . . . 96.6 m95 -74.95 82.49 2.2 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 123.91 0.884 . . . . 0.0 110.286 174.654 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 60.6 mm-40 -106.06 123.07 40.26 Favored Pre-proline 0 N--CA 1.465 0.299 0 C-N-CA 123.751 0.82 . . . . 0.0 109.432 178.326 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' PRO . . . . . 0.535 ' O ' HG12 ' A' ' 42' ' ' ILE . 38.3 Cg_endo -64.19 165.05 20.6 Favored 'Trans proline' 0 C--N 1.368 1.6 0 C-N-CA 122.361 2.04 . . . . 0.0 112.15 173.393 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLU . . . . . . . . . . . . . 10.5 pt-20 -56.43 -27.92 57.97 Favored 'General case' 0 N--CA 1.489 1.488 0 C-N-CA 124.192 0.997 . . . . 0.0 111.021 172.888 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLU . . . . . . . . . . . . . 37.6 tt0 -55.5 -45.26 77.06 Favored 'General case' 0 CA--C 1.555 1.14 0 C-N-CA 125.604 1.561 . . . . 0.0 111.226 169.514 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' HIS . . . . . 0.418 ' HE1' ' HG3' ' B' ' 30' ' ' PRO . 42.5 m170 -88.13 -7.29 57.15 Favored 'General case' 0 N--CA 1.481 1.112 0 C-N-CA 124.066 0.946 . . . . 0.0 113.169 -176.177 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' ILE . . . . . 0.65 HD12 ' HB1' ' B' ' 25' ' ' ALA . 41.8 mm -94.26 139.22 18.86 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 C-N-CA 123.814 0.846 . . . . 0.0 109.833 179.857 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' LEU . . . . . 0.579 ' HG ' ' HB2' ' B' ' 26' ' ' ARG . 94.9 mt -71.48 -64.76 0.86 Allowed 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 122.833 0.453 . . . . 0.0 110.078 175.941 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' ASP . . . . . . . . . . . . . 15.5 t70 -83.69 109.99 22.04 Favored Pre-proline 0 CA--C 1.556 1.184 0 CA-C-N 115.499 -0.773 . . . . 0.0 109.161 -177.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' PRO . . . . . . . . . . . . . 95.1 Cg_endo -75.8 -9.89 19.78 Favored 'Trans proline' 0 C--N 1.367 1.519 0 C-N-CA 122.782 2.321 . . . . 0.0 112.704 -176.281 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ARG . . . . . . . . . . . . . 78.7 mtm180 -72.89 -12.63 61.04 Favored 'General case' 0 CA--C 1.545 0.76 0 C-N-CA 123.311 0.644 . . . . 0.0 111.341 -176.906 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' LEU . . . . . . . . . . . . . 3.9 mm? -57.89 -43.38 86.07 Favored 'General case' 0 N--CA 1.49 1.57 0 C-N-CA 122.914 0.486 . . . . 0.0 110.975 169.134 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' VAL . . . . . . . . . . . . . 47.6 t -64.81 -42.05 93.85 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.99 0 C-N-CA 123.693 0.797 . . . . 0.0 109.938 178.88 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' MET . . . . . 0.401 ' O ' ' HG2' ' A' ' 53' ' ' GLU . 24.7 mmt -60.36 -47.49 85.81 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 114.62 -1.173 . . . . 0.0 110.276 177.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' ALA . . . . . . . . . . . . . . . -62.26 -35.9 80.4 Favored 'General case' 0 N--CA 1.486 1.362 0 C-N-CA 124.507 1.123 . . . . 0.0 111.565 -178.494 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' TYR . . . . . 0.429 ' O ' ' HG3' ' A' ' 54' ' ' LYS . 87.7 t80 -68.08 -34.08 75.75 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 123.89 0.876 . . . . 0.0 110.774 176.005 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -90.79 -9.06 47.95 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 122.932 0.493 . . . . 0.0 111.881 -179.648 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLU . . . . . 0.401 ' HG2' ' O ' ' A' ' 49' ' ' MET . 30.0 mm-40 -64.82 -42.98 94.55 Favored 'General case' 0 N--CA 1.484 1.263 0 C-N-CA 122.933 0.493 . . . . 0.0 110.02 171.456 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.429 ' HG3' ' O ' ' A' ' 51' ' ' TYR . 0.0 OUTLIER -80.14 -35.71 36.24 Favored 'General case' 0 CA--C 1.543 0.685 0 CA-C-N 115.53 -0.759 . . . . 0.0 110.993 175.269 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' GLU . . . . . . . . . . . . . 2.0 tp10 -67.52 143.64 56.05 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.193 0.597 . . . . 0.0 110.065 -175.39 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 7.8 pt-20 . . . . . 0 CA--C 1.556 1.178 0 C-N-CA 123.28 0.632 . . . . 0.0 110.014 -176.096 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 19' ' ' GLN . . . . . . . . . . . . . 20.3 pt20 . . . . . 0 C--O 1.242 0.697 0 N-CA-C 109.985 -0.376 . . . . 0.0 109.985 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 20' ' ' LEU . . . . . . . . . . . . . 8.7 tt -80.57 128.94 34.18 Favored 'General case' 0 C--O 1.241 0.606 0 N-CA-C 108.195 -1.039 . . . . 0.0 108.195 178.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 21' ' ' ALA . . . . . . . . . . . . . . . -67.5 88.33 0.21 Allowed 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.614 0.766 . . . . 0.0 110.306 -179.199 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 22' ' ' THR . . . . . . . . . . . . . 17.4 m -80.9 77.47 7.78 Favored 'General case' 0 C--O 1.242 0.664 0 CA-C-O 121.939 0.876 . . . . 0.0 110.834 -172.297 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -132.09 173.6 11.06 Favored 'General case' 0 C--O 1.248 0.991 0 C-N-CA 125.346 1.458 . . . . 0.0 107.539 170.195 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 24' ' ' ALA . . . . . . . . . . . . . . . -113.76 112.02 22.73 Favored 'General case' 0 C--O 1.24 0.594 0 CA-C-O 121.423 0.63 . . . . 0.0 110.63 -179.062 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 25' ' ' ALA . . . . . 0.65 ' HB1' HD12 ' A' ' 42' ' ' ILE . . . -85.87 168.94 13.77 Favored 'General case' 0 C--O 1.246 0.913 0 CA-C-N 114.467 -1.242 . . . . 0.0 108.464 165.656 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 26' ' ' ARG . . . . . 0.579 ' HB2' ' HG ' ' A' ' 43' ' ' LEU . 23.1 ttt180 -140.47 149.66 42.81 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-O 121.488 0.661 . . . . 0.0 111.289 -175.096 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 27' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.717 0 N-CA-C 107.778 -1.194 . . . . 0.0 107.778 166.143 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 28' ' ' SER . . . . . . . . . . . . . 22.9 t -64.95 112.83 3.48 Favored 'General case' 0 C--N 1.356 0.879 0 N-CA-C 108.815 -0.809 . . . . 0.0 108.815 174.73 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 29' ' ' ALA . . . . . . . . . . . . . . . -65.93 121.67 77.07 Favored Pre-proline 0 CA--C 1.547 0.847 0 C-N-CA 124.252 1.021 . . . . 0.0 110.922 -170.028 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 30' ' ' PRO . . . . . 0.418 ' HG3' ' HE1' ' A' ' 41' ' ' HIS . 7.5 Cg_exo -70.71 124.0 10.3 Favored 'Trans proline' 0 C--N 1.376 1.988 0 C-N-CA 122.488 2.125 . . . . 0.0 110.839 174.955 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' B' B ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.33 106.02 0.69 Allowed 'General case' 0 N--CA 1.477 0.88 0 C-N-CA 123.489 0.716 . . . . 0.0 109.507 178.378 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 32' ' ' THR . . . . . . . . . . . . . 60.6 p 56.52 18.37 3.51 Favored 'General case' 0 N--CA 1.493 1.695 0 C-N-CA 125.737 1.615 . . . . 0.0 112.854 -175.889 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 33' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.03 0 CA-C-O 119.229 -0.762 . . . . 0.0 111.741 -179.413 . . . . . . . . 0 0 . 1 stop_ save_