data_2l11_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 2l11 _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' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 . . . . . 0 N--CA 1.47 0.57 0 CA-C-O 120.795 0.331 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.3 p -78.5 119.67 27.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.7 0 C-N-CA 123.153 0.581 . . . . 0.0 110.354 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.469 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.5 p -93.24 137.55 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.566 172.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.15 -51.5 8.9 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.614 0.766 . . . . 0.0 110.829 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -161.25 169.45 22.16 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.671 0.607 . . . . 0.0 111.511 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.6 t -100.19 143.12 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.286 172.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.401 HD12 ' ND2' ' A' ' 32' ' ' ASN . 72.4 mt -108.52 -39.2 5.47 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.218 1.007 . . . . 0.0 111.429 178.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -154.02 166.4 33.13 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 122.755 0.422 . . . . 0.0 110.957 -174.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.532 HH11 HD23 ' A' ' 50' ' ' LEU . 53.5 ttt180 -142.2 148.73 38.67 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.738 1.215 . . . . 0.0 110.36 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -152.36 174.56 13.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.723 1.209 . . . . 0.0 109.25 173.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.566 HG22 HG21 ' A' ' 18' ' ' VAL . 94.6 t -123.11 116.03 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.667 0.787 . . . . 0.0 109.796 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -118.56 121.24 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.074 0.949 . . . . 0.0 109.369 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 64.05 23.6 13.29 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.86 1.264 . . . . 0.0 112.252 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.51 -23.35 32.64 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.444 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.89 157.33 24.39 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.942 0.897 . . . . 0.0 109.116 176.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.566 HG21 HG22 ' A' ' 13' ' ' VAL . 99.4 t -113.08 114.29 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.476 0.71 . . . . 0.0 109.438 -173.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -109.39 134.37 51.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.631 0.773 . . . . 0.0 110.562 -177.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -108.77 128.46 54.9 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.055 0.942 . . . . 0.0 109.774 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.92 108.37 9.92 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 32' ' ' ASN . 57.8 mt -82.8 -174.71 5.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.547 0.689 . . . . 0.0 112.236 -171.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -144.71 112.91 6.47 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 103.947 -2.612 . . . . 0.0 103.947 163.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.469 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 87.5 m95 -79.03 147.75 32.73 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.012 0.434 . . . . 0.0 111.411 -173.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.442 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -85.1 -36.21 21.3 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.506 172.525 . . . . . . . . 3 3 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -73.19 -28.98 65.17 Favored Glycine 0 C--N 1.357 1.696 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.317 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -120.43 171.91 8.19 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.769 0.828 . . . . 0.0 110.956 -174.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.6 p -70.65 161.78 30.14 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 123.182 0.593 . . . . 0.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.72 -27.09 65.63 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.4 0.68 . . . . 0.0 112.109 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.46 -19.02 34.05 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.449 0.7 . . . . 0.0 111.263 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.53 1.62 41.05 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.37 0.668 . . . . 0.0 110.886 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.465 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 31.1 p-10 -56.96 146.98 25.1 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 124.368 1.067 . . . . 0.0 112.718 175.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.2 p -140.9 158.71 43.57 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.4 -173.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -76.95 115.95 17.19 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.111 0.965 . . . . 0.0 110.31 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -124.56 131.3 24.14 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.561 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 63.8 Cg_endo -70.85 154.61 63.33 Favored 'Trans proline' 0 C--N 1.365 1.395 0 C-N-CA 122.439 2.092 . . . . 0.0 112.438 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -28.34 56.45 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.469 1.107 . . . . 0.0 112.289 178.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.532 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.3 pt-20 -66.27 -31.92 73.02 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 123.664 0.603 . . . . 0.0 111.279 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.402 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 3.1 m-20 -93.9 -18.47 21.93 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.942 0.897 . . . . 0.0 111.593 177.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.434 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 61.1 mt -76.75 124.86 28.31 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 176.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -103.48 23.82 12.0 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 171.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' B' ' 5' ' ' GLN . 21.3 p -112.52 89.67 13.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 123.942 0.897 . . . . 0.0 110.505 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -73.63 -33.02 7.08 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.888 2.392 . . . . 0.0 111.814 173.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.96 -50.21 73.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.559 -1.201 . . . . 0.0 111.418 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.426 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 77.8 mt -70.22 -36.84 74.83 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.599 -175.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.2 -49.7 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.803 0.441 . . . . 0.0 110.405 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.97 -50.63 72.72 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.573 0.546 . . . . 0.0 110.626 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.62 -38.76 85.81 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 124.056 0.848 . . . . 0.0 111.457 -176.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -64.06 -42.92 96.85 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.733 0.813 . . . . 0.0 111.508 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.532 HD23 HH11 ' A' ' 11' ' ' ARG . 84.2 mt -68.52 -35.46 77.5 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.092 0.557 . . . . 0.0 110.396 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -66.4 -31.34 72.04 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.136 0.974 . . . . 0.0 110.948 175.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 123.377 0.671 . . . . 0.0 110.833 177.276 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.473 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.7 mm-40 . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 28.2 p -97.71 147.38 24.42 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.391 0.676 . . . . 0.0 111.215 -175.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.12 144.02 24.53 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.145 0.978 . . . . 0.0 109.845 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.402 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 16.1 mtp180 . . . . . 0 N--CA 1.469 0.498 0 C-N-CA 124.182 0.993 . . . . 0.0 108.69 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.1 t80 . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.42 109.71 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.544 0.738 . . . . 0.0 111.887 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.525 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.7 p -85.11 137.48 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 165.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -76.74 -54.64 6.36 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.199 0.6 . . . . 0.0 110.311 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.406 ' HA ' HD13 ' A' ' 45' ' ' LEU . 19.3 ptmt -160.28 164.94 32.23 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.001 0.52 . . . . 0.0 111.97 177.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.4 HG12 ' HD2' ' A' ' 20' ' ' TYR . 89.6 t -86.73 134.58 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.356 1.062 . . . . 0.0 109.614 171.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.2 mt -101.6 -39.15 7.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.507 0.723 . . . . 0.0 110.887 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -149.41 165.37 32.27 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.518 0.327 . . . . 0.0 110.696 -172.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -132.97 144.03 49.85 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.277 1.031 . . . . 0.0 109.154 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.34 172.44 15.38 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.778 0.831 . . . . 0.0 109.684 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.504 HG22 HG21 ' A' ' 18' ' ' VAL . 76.5 t -127.5 121.95 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.302 1.041 . . . . 0.0 108.976 175.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.459 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 69.2 t -129.38 125.79 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 63.96 20.0 12.01 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.412 1.085 . . . . 0.0 112.332 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.79 -12.86 62.63 Favored Glycine 0 C--N 1.348 1.244 0 CA-C-O 119.949 -0.362 . . . . 0.0 113.974 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptpt -98.4 165.32 11.9 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.404 0.602 . . . . 0.0 109.459 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.504 HG21 HG22 ' A' ' 13' ' ' VAL . 56.5 t -107.96 119.37 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.12 0.568 . . . . 0.0 109.685 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.7 mt-10 -110.16 139.0 45.77 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.406 0.682 . . . . 0.0 110.211 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.4 ' HD2' HG12 ' A' ' 8' ' ' VAL . 61.7 m-85 -111.57 140.68 45.98 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.659 0.784 . . . . 0.0 110.11 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -79.08 108.04 12.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.464 HD21 HG23 ' A' ' 5' ' ' VAL . 23.2 mt -95.37 120.47 35.67 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.115 0.566 . . . . 0.0 110.757 -174.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.734 ' HD3' ' HA ' ' A' ' 29' ' ' ASP . 0.0 OUTLIER -91.62 113.03 25.19 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 166.33 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.525 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 68.9 m95 -79.06 150.12 31.94 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.817 0.847 . . . . 0.0 111.03 -173.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -88.79 -39.37 13.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.944 0.498 . . . . 0.0 111.156 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.67 -33.37 60.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.217 177.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -94.03 162.44 13.88 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.398 0.679 . . . . 0.0 110.289 174.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.1 p -72.36 172.11 10.97 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.507 0.723 . . . . 0.0 111.631 -177.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.734 ' HA ' ' HD3' ' A' ' 23' ' ' LYS . 1.2 m-20 -69.44 -17.59 63.65 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.281 0.632 . . . . 0.0 110.919 173.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.75 -19.09 60.37 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.778 0.831 . . . . 0.0 111.7 173.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -121.78 85.36 2.4 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.634 0.731 . . . . 0.0 109.466 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.405 ' HB3' ' HA ' ' A' ' 23' ' ' LYS . 6.9 p30 -125.61 136.48 53.31 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.749 1.22 . . . . 0.0 110.179 173.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.2 p -130.85 154.79 47.68 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.656 0.783 . . . . 0.0 111.114 -173.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -80.84 123.68 28.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.967 0.907 . . . . 0.0 110.313 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -123.79 138.94 31.29 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 123.186 0.594 . . . . 0.0 109.563 171.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.529 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 60.9 Cg_endo -68.83 158.94 55.84 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 122.726 2.284 . . . . 0.0 112.302 175.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.452 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 11.3 pt-20 -65.74 -26.05 67.56 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.106 0.562 . . . . 0.0 111.615 -175.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.473 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.9 pt-20 -62.07 -32.19 72.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.959 0.904 . . . . 0.0 110.971 175.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.427 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 7.9 m-20 -80.09 -32.32 39.2 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.85 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.452 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 13.4 mt -72.27 131.97 43.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.055 -176.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -123.97 66.38 1.04 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.659 ' SG ' ' HG2' ' B' ' 5' ' ' GLN . 36.2 t -152.6 112.07 2.77 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 114.38 -1.282 . . . . 0.0 110.353 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -78.71 -23.54 8.14 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.125 1.883 . . . . 0.0 111.885 168.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -63.32 -58.7 6.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.987 0.915 . . . . 0.0 111.872 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.454 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 87.5 mt -72.18 -39.16 68.85 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.642 0.777 . . . . 0.0 112.285 -169.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.7 mt -65.41 -51.2 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 123.692 0.62 . . . . 0.0 110.406 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -66.0 -40.66 91.34 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.076 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.29 -37.06 86.01 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.832 0.453 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.13 -46.27 91.26 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.783 0.833 . . . . 0.0 110.534 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.2 mt -68.48 -37.22 79.95 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.145 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -82.61 -14.86 54.05 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.635 0.774 . . . . 0.0 112.077 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 t . . . . . 0 N--CA 1.485 1.29 0 C-N-CA 123.171 0.588 . . . . 0.0 109.901 174.44 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.659 ' HG2' ' SG ' ' A' ' 42' ' ' CYS . 2.0 mp0 . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 54.1 m -72.06 117.78 14.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.449 1.1 . . . . 0.0 109.707 177.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.67 110.81 7.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.05 0.54 . . . . 0.0 109.918 176.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.427 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 39.6 ttt180 . . . . . 0 CA--C 1.536 0.431 0 C-N-CA 124.548 1.139 . . . . 0.0 111.085 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.467 HG11 ' O ' ' A' ' 25' ' ' LYS . 3.0 p -113.23 125.18 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 123.124 0.57 . . . . 0.0 110.658 -174.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.1 p -114.88 140.04 38.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 124.677 1.191 . . . . 0.0 110.405 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -73.24 -57.34 4.09 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.365 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.417 ' HA ' HD21 ' A' ' 45' ' ' LEU . 21.2 ptmt -164.2 162.57 22.76 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.307 0.575 . . . . 0.0 112.368 -174.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.493 HG21 ' HB3' ' A' ' 45' ' ' LEU . 93.3 t -84.3 143.7 11.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-N 114.649 -1.159 . . . . 0.0 108.857 169.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.54 -42.57 4.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.236 0.614 . . . . 0.0 110.577 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -151.77 164.86 36.1 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.84 0.456 . . . . 0.0 110.538 -171.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -124.18 159.54 29.87 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.415 1.086 . . . . 0.0 110.206 -174.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -159.43 167.09 29.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.634 0.774 . . . . 0.0 109.329 173.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -121.89 121.11 63.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.51 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 89.9 t -125.3 114.85 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.239 1.016 . . . . 0.0 109.041 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 65.78 12.06 8.05 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.329 1.051 . . . . 0.0 112.275 174.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 110.56 -25.04 16.06 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 123.315 0.484 . . . . 0.0 113.37 -174.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.8 ptpt -81.52 174.26 11.6 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 85.1 t -120.79 123.77 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.592 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 39.9 mt-10 -105.51 138.33 41.88 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.228 0.537 . . . . 0.0 110.341 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -111.84 136.66 50.83 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.548 1.139 . . . . 0.0 109.171 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -80.21 105.56 11.57 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.419 HD23 HG23 ' A' ' 5' ' ' VAL . 23.5 mt -91.62 112.63 24.63 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.512 -175.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.0 105.83 16.05 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 165.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.563 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 80.3 m95 -73.84 154.01 39.66 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.439 0.695 . . . . 0.0 112.039 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.467 ' O ' HG11 ' A' ' 4' ' ' VAL . 25.4 ttpp -112.14 151.41 29.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.1 -48.32 4.01 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -174.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -66.96 165.62 15.21 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.201 1.0 . . . . 0.0 109.584 165.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -65.75 152.43 44.32 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-O 120.812 0.339 . . . . 0.0 110.988 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.45 -31.56 70.95 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.764 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.38 -17.46 56.43 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.192 0.597 . . . . 0.0 111.597 176.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -84.59 65.32 8.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.856 0.862 . . . . 0.0 109.486 -178.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.551 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 16.2 p30 -111.03 149.08 31.24 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.006 1.322 . . . . 0.0 110.57 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 52.5 p -139.36 164.52 29.62 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.938 0.895 . . . . 0.0 110.476 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -86.15 123.78 31.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.72 133.69 24.99 Favored Pre-proline 0 N--CA 1.472 0.634 0 C-N-CA 122.818 0.447 . . . . 0.0 110.576 172.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.592 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 43.7 Cg_endo -65.77 160.61 42.88 Favored 'Trans proline' 0 C--N 1.366 1.485 0 C-N-CA 122.572 2.181 . . . . 0.0 112.384 176.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -25.47 65.58 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.62 1.168 . . . . 0.0 112.021 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.418 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 13.0 pt-20 -68.68 -23.02 64.34 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -89.98 -22.58 21.85 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.689 1.195 . . . . 0.0 111.488 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.403 ' CD2' HD11 ' A' ' 22' ' ' LEU . 21.1 mt -77.79 117.0 18.74 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.901 0.48 . . . . 0.0 111.426 -172.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.29 -27.56 27.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.506 ' SG ' ' HG ' ' A' ' 45' ' ' LEU . 51.1 t -80.62 109.38 12.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 123.891 0.876 . . . . 0.0 110.714 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -79.07 -17.86 11.66 Favored 'Trans proline' 0 C--N 1.377 2.037 0 C-N-CA 122.274 1.983 . . . . 0.0 111.476 173.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.431 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 12.7 tp10 -65.52 -52.44 52.59 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 124.644 1.178 . . . . 0.0 110.917 -176.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.506 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 75.3 mt -64.9 -29.23 70.16 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.196 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.505 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 31.7 mt -70.63 -55.84 12.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.23 -55.83 21.65 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.474 -170.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.74 79.28 Favored 'General case' 0 N--CA 1.481 1.109 0 O-C-N 124.082 0.863 . . . . 0.0 111.611 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -63.98 -39.03 93.2 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.463 1.105 . . . . 0.0 111.727 177.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 89.7 mt -67.76 -38.11 83.01 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.535 0.334 . . . . 0.0 110.281 178.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.04 -28.33 65.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.664 . . . . 0.0 111.195 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 123.243 0.617 . . . . 0.0 111.451 176.737 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.421 HE22 HD22 ' A' ' 45' ' ' LEU . 13.0 mt-30 . . . . . 0 N--CA 1.471 0.595 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 19.2 m -111.02 150.14 29.73 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 121.49 0.662 . . . . 0.0 111.151 -165.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.49 18.39 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 124.934 1.293 . . . . 0.0 109.381 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.38 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.465 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 11.1 m -66.75 134.0 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.019 176.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.444 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -101.97 131.65 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.568 0.747 . . . . 0.0 109.351 173.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.37 -56.28 7.05 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.379 0.671 . . . . 0.0 110.585 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.432 ' HA ' HD22 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -159.3 163.07 36.05 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.121 0.486 . . . . 0.0 111.673 -177.234 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.412 HG21 ' HB3' ' A' ' 45' ' ' LEU . 72.2 t -82.04 129.19 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.586 171.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.3 mt -86.67 -54.5 4.35 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.199 1.0 . . . . 0.0 110.176 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -151.9 164.51 36.95 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.27 -172.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -131.17 141.22 50.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.392 1.077 . . . . 0.0 109.297 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -136.45 171.05 15.06 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.786 0.834 . . . . 0.0 109.561 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 17' ' ' LYS . 90.4 t -124.1 115.2 44.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 124.205 1.002 . . . . 0.0 108.95 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.418 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 92.4 t -126.31 127.97 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.7 t30 66.08 15.86 10.24 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.2 1.0 . . . . 0.0 111.031 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.54 14.57 75.74 Favored Glycine 0 C--N 1.35 1.33 0 CA-C-N 116.03 -0.532 . . . . 0.0 113.651 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 14.5 ptmt -108.92 157.25 18.8 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.4 t -96.67 125.24 49.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.554 0.741 . . . . 0.0 109.742 177.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.472 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 47.1 mt-10 -120.93 135.98 55.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.389 0.676 . . . . 0.0 109.997 174.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.411 ' HE2' ' HB3' ' A' ' 37' ' ' GLU . 96.3 m-85 -109.79 129.47 55.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.447 1.099 . . . . 0.0 109.893 177.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.23 107.95 8.82 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 174.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.3 mt -102.66 127.44 49.77 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 122.876 0.47 . . . . 0.0 111.347 -172.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? -96.01 121.28 37.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.444 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 66.4 m95 -82.2 137.77 34.84 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.147 0.579 . . . . 0.0 111.27 -173.025 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -76.6 132.28 39.36 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 123.665 0.786 . . . . 0.0 110.576 -173.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.78 -0.24 89.58 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.689 0.618 . . . . 0.0 113.834 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -104.86 173.36 6.33 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.324 1.05 . . . . 0.0 110.966 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.1 p -65.44 162.05 18.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.791 0.836 . . . . 0.0 112.015 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.81 -41.6 99.36 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.532 0.733 . . . . 0.0 111.248 -176.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.63 -16.59 63.41 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.256 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -81.24 77.73 8.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.139 0.976 . . . . 0.0 109.168 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -143.02 131.51 22.33 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 113.987 -1.461 . . . . 0.0 109.794 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 p -131.74 147.42 52.5 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.957 0.903 . . . . 0.0 110.465 -173.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -76.49 109.53 10.3 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.88 0.472 . . . . 0.0 110.041 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -114.12 129.69 24.59 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.403 1.081 . . . . 0.0 110.458 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.472 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 72.7 Cg_endo -72.29 150.81 53.56 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.442 2.095 . . . . 0.0 111.985 175.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.499 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.06 -26.69 64.84 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.319 1.048 . . . . 0.0 113.09 -176.671 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.85 -31.56 72.58 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.658 0.783 . . . . 0.0 111.215 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -91.44 -14.23 30.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.033 0.933 . . . . 0.0 110.555 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.499 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 10.0 mt -79.07 141.01 37.74 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.786 0.434 . . . . 0.0 110.096 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -97.06 0.2 48.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.505 ' HA ' ' HG2' ' B' ' 5' ' ' GLN . 33.5 t -111.02 96.98 32.55 Favored Pre-proline 0 C--N 1.356 0.848 0 C-N-CA 123.661 0.785 . . . . 0.0 111.453 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -78.85 -17.15 12.41 Favored 'Trans proline' 0 C--N 1.375 1.953 0 C-N-CA 122.665 2.243 . . . . 0.0 111.578 169.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -71.13 -43.94 66.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.024 0.929 . . . . 0.0 110.737 -176.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 7' ' ' LYS . 21.2 mt -68.35 -40.18 81.61 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.124 0.569 . . . . 0.0 111.55 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.523 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 66.6 mt -58.62 -52.15 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 123.814 0.696 . . . . 0.0 109.781 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.9 -52.66 64.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.568 0.747 . . . . 0.0 111.298 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.32 71.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.856 0.862 . . . . 0.0 111.598 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.7 -45.3 71.96 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.129 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 79.9 mt -64.85 -35.97 82.85 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 110.403 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.04 -29.09 61.73 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.101 0.96 . . . . 0.0 110.299 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 24.8 t . . . . . 0 CA--C 1.552 1.035 0 C-N-CA 123.43 0.692 . . . . 0.0 110.626 177.306 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.505 ' HG2' ' HA ' ' A' ' 42' ' ' CYS . 4.6 tp-100 . . . . . 0 CA--C 1.545 0.778 0 CA-C-O 121.38 0.61 . . . . 0.0 111.457 . . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 2.0 m -107.02 171.88 7.13 Favored 'General case' 0 CA--C 1.561 1.374 0 C-N-CA 124.021 0.928 . . . . 0.0 110.729 -166.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.8 144.46 17.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.751 0.82 . . . . 0.0 109.423 171.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 . . . . . 0 N--CA 1.479 0.994 0 C-N-CA 122.977 0.511 . . . . 0.0 109.995 177.127 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 . . . . . 0 N--CA 1.473 0.712 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -80.66 110.81 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.825 0.821 . . . . 0.0 110.388 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.412 HG21 HD23 ' A' ' 22' ' ' LEU . 1.4 p -81.6 131.39 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.733 168.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.505 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 39.1 tt0 -74.94 -49.49 19.97 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 174.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.562 ' HZ1' ' HB2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -161.89 162.42 29.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.318 0.58 . . . . 0.0 111.015 -172.825 . . . . . . . . 3 3 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.443 HG13 ' HD2' ' A' ' 20' ' ' TYR . 61.1 t -89.99 141.27 14.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.363 172.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.3 mt -105.42 -47.6 3.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.96 0.904 . . . . 0.0 109.918 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -144.62 164.47 30.85 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 55.6 ttt180 -138.75 126.5 22.16 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.324 1.05 . . . . 0.0 109.509 -175.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -126.83 164.17 21.98 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.761 0.824 . . . . 0.0 109.856 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.8 t -125.61 116.79 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.2 t -123.62 118.9 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.088 0.955 . . . . 0.0 109.559 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 62.34 32.6 16.88 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.811 1.245 . . . . 0.0 111.784 175.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.2 -26.81 11.8 Favored Glycine 0 N--CA 1.472 1.046 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.301 -177.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -79.44 152.74 30.14 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 123.995 0.918 . . . . 0.0 109.48 -177.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.9 t -114.34 113.69 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.578 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 49.7 mt-10 -106.49 153.47 22.25 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.971 0.908 . . . . 0.0 110.536 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.443 ' HD2' HG13 ' A' ' 8' ' ' VAL . 92.6 m-85 -132.01 126.88 35.02 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.296 1.038 . . . . 0.0 108.95 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -77.55 107.47 10.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.412 HD23 HG21 ' A' ' 5' ' ' VAL . 42.3 mt -96.71 123.34 40.37 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.112 0.565 . . . . 0.0 111.734 -168.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -73.83 106.05 5.38 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 165.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.473 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 76.4 m95 -78.93 116.92 19.55 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 173.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . 38.7 ttpt -61.9 -41.05 97.43 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.756 0.823 . . . . 0.0 112.338 -170.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.62 5.83 79.99 Favored Glycine 0 CA--C 1.534 1.274 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -132.09 170.73 14.56 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.691 0.796 . . . . 0.0 111.407 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 77.5 p -72.83 160.99 31.29 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.533 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.9 -29.56 63.24 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.342 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -22.43 63.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.991 0.516 . . . . 0.0 111.351 174.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -92.29 -1.13 57.28 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.541 0.737 . . . . 0.0 111.164 -178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.473 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 84.4 m-20 -64.89 139.49 58.77 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.978 0.511 . . . . 0.0 110.666 173.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 39.5 p -131.57 155.77 46.92 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.185 0.594 . . . . 0.0 112.116 -170.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -77.3 113.48 15.12 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.532 0.733 . . . . 0.0 109.444 171.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -121.9 129.56 25.1 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 122.913 0.485 . . . . 0.0 110.379 176.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.578 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 73.4 Cg_endo -71.75 149.89 55.23 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 122.737 2.291 . . . . 0.0 112.18 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.433 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 9.5 pt-20 -60.28 -24.0 64.58 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.867 0.867 . . . . 0.0 112.741 -175.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 9.3 pt-20 -65.81 -35.36 80.48 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.902 0.881 . . . . 0.0 111.307 175.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -82.42 -21.94 35.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.386 1.074 . . . . 0.0 110.687 -175.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.491 HD23 ' HB1' ' B' ' 7' ' ' ALA . 7.6 mt -86.14 142.14 28.87 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -108.75 26.13 10.93 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 173.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 47.0 t -117.28 90.85 35.4 Favored Pre-proline 0 C--N 1.346 0.451 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.902 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -70.96 -22.16 26.93 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 122.507 2.138 . . . . 0.0 111.013 170.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.86 -60.18 3.95 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 124.118 0.967 . . . . 0.0 111.445 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.441 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 89.6 mt -78.22 -29.73 48.45 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.802 0.441 . . . . 0.0 112.027 -172.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.462 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 93.0 mt -63.68 -56.08 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -41.56 69.66 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.594 -174.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -34.23 77.68 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.046 0.216 . . . . 0.0 111.148 -177.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -60.42 -44.21 95.98 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.606 0.762 . . . . 0.0 110.799 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 69.4 mt -66.92 -39.02 87.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.781 178.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -71.61 -21.77 61.8 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.904 0.882 . . . . 0.0 111.42 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.477 0.911 0 C-N-CA 123.064 0.545 . . . . 0.0 110.226 173.702 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.479 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 20.5 tp60 . . . . . 0 CA--C 1.545 0.756 0 CA-C-O 120.948 0.404 . . . . 0.0 110.029 . . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -86.75 173.98 9.12 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 124.106 0.963 . . . . 0.0 113.075 -160.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . 0.491 ' HB1' HD23 ' A' ' 40' ' ' LEU . . . -147.78 155.06 41.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 . . . . . 0 CA--C 1.548 0.896 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.158 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 47.1 t80 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 65.5 t -77.68 116.87 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.086 0.555 . . . . 0.0 110.926 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.446 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.2 p -92.55 142.0 13.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 123.863 0.865 . . . . 0.0 110.66 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -79.64 -57.85 3.47 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.173 0.989 . . . . 0.0 110.848 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -160.81 169.39 22.8 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.794 0.438 . . . . 0.0 111.866 -175.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.456 HG12 ' HB3' ' A' ' 20' ' ' TYR . 43.9 t -92.17 141.45 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.061 0.944 . . . . 0.0 109.194 171.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.1 mt -111.43 -35.4 5.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.508 1.123 . . . . 0.0 110.786 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -157.26 164.62 37.49 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.434 0.694 . . . . 0.0 109.812 -173.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -132.7 154.02 50.56 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.985 0.914 . . . . 0.0 109.971 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.24 161.47 40.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.956 0.902 . . . . 0.0 109.28 174.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t -116.87 124.19 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 169.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.0 t -112.49 108.83 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 176.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 64.97 -73.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.153 1.381 . . . . 0.0 111.033 -172.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -147.72 -9.34 0.2 Allowed Glycine 0 CA--C 1.528 0.852 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.607 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HE2' ' HB3' ' A' ' 36' ' ' PRO . 15.6 ptmt -81.28 170.47 16.02 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 99.1 t -124.51 127.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.139 0.576 . . . . 0.0 109.497 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -118.33 139.52 51.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.456 ' HB3' HG12 ' A' ' 8' ' ' VAL . 98.0 m-85 -111.28 132.66 54.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.293 1.037 . . . . 0.0 109.641 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -78.42 108.56 11.86 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.8 mt -101.41 123.04 44.84 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.34 0.656 . . . . 0.0 112.169 -168.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -78.07 110.13 12.76 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 165.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.543 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 71.9 m95 -80.7 148.95 29.94 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 122.862 0.465 . . . . 0.0 110.342 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -58.52 -48.44 80.84 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 123.67 0.606 . . . . 0.0 110.94 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.76 15.3 52.61 Favored Glycine 0 C--N 1.34 0.805 0 CA-C-N 115.584 -0.735 . . . . 0.0 114.207 -173.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.543 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 55.5 m-85 -132.83 136.64 46.38 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 117.605 0.702 . . . . 0.0 109.925 175.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.5 p -80.71 -179.22 7.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.292 1.037 . . . . 0.0 111.835 -175.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -49.83 -51.45 39.83 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.135 1.374 . . . . 0.0 113.582 -170.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.12 -20.84 62.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . 0.419 ' HB3' ' HB3' ' A' ' 27' ' ' PHE . 11.1 t70 -91.25 -17.85 25.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.833 0.453 . . . . 0.0 111.209 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -58.17 136.99 57.36 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.479 0.712 . . . . 0.0 111.672 -177.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.8 p -128.41 156.79 42.6 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.372 0.669 . . . . 0.0 112.669 -166.758 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -80.32 117.53 21.16 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.095 0.958 . . . . 0.0 110.369 173.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -118.66 135.52 23.72 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 123.006 0.523 . . . . 0.0 110.311 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.493 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . 94.9 Cg_endo -74.55 150.94 41.29 Favored 'Trans proline' 0 C--N 1.365 1.425 0 C-N-CA 122.463 2.109 . . . . 0.0 112.511 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -27.69 64.46 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.032 0.933 . . . . 0.0 112.572 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.493 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 15.7 pt-20 -60.7 -35.75 77.08 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.199 0.6 . . . . 0.0 110.94 177.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -83.51 -34.78 25.24 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.788 0.835 . . . . 0.0 111.149 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.51 HD12 HD13 ' A' ' 46' ' ' ILE . 19.2 mt -62.78 136.75 58.03 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -170.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -108.57 29.52 7.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 171.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 19.7 m -116.27 89.51 26.39 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.262 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.97 -26.48 6.58 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.742 1.628 . . . . 0.0 111.097 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.51 -56.14 13.99 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 124.328 1.051 . . . . 0.0 111.127 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.529 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 83.9 mt -65.95 -40.26 91.17 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.677 0.61 . . . . 0.0 111.638 -174.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.51 HD13 HD12 ' A' ' 40' ' ' LEU . 76.5 mt -66.36 -47.94 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.472 0.483 . . . . 0.0 110.54 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.34 -50.85 72.16 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.317 0.647 . . . . 0.0 110.794 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -37.25 85.92 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.534 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -64.2 -49.75 70.79 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.132 0.973 . . . . 0.0 110.805 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.0 mt -66.24 -38.61 88.3 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.904 -177.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -78.16 -18.32 55.71 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.8 t . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 120.898 0.38 . . . . 0.0 110.016 174.162 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.529 ' HG3' ' HG ' ' A' ' 45' ' ' LEU . 87.4 mm-40 . . . . . 0 N--CA 1.469 0.486 0 CA-C-O 120.742 0.306 . . . . 0.0 110.556 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 37.4 m -110.63 137.35 48.43 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.534 0.733 . . . . 0.0 109.24 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -129.1 145.47 51.28 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.866 0.866 . . . . 0.0 108.988 176.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 67.2 mtt85 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.852 -172.585 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 . . . . . 0 N--CA 1.469 0.488 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.49 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 47.0 t -84.35 132.08 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 176.192 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.476 HG23 HD22 ' A' ' 22' ' ' LEU . 1.2 p -100.88 121.8 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 109.325 -0.621 . . . . 0.0 109.325 172.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.575 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 14.8 tp10 -53.59 -57.22 11.52 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.554 1.142 . . . . 0.0 110.821 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -164.21 162.03 22.42 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 -174.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.503 HG12 ' HB3' ' A' ' 20' ' ' TYR . 85.9 t -85.28 116.71 29.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.1 mt -82.9 -35.69 25.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.013 0.525 . . . . 0.0 111.888 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -164.56 162.73 21.84 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.259 0.349 . . . . 0.0 110.995 -171.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.477 ' NH2' HD23 ' A' ' 50' ' ' LEU . 31.3 ttm180 -118.59 149.26 41.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.309 1.044 . . . . 0.0 109.539 173.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -132.2 160.78 35.12 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 165.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 85.9 t -120.95 108.46 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 167.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.61 128.56 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 66.02 22.2 11.23 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.843 1.257 . . . . 0.0 111.772 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.45 6.08 89.05 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.781 -0.645 . . . . 0.0 113.357 -176.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -104.26 143.13 33.37 Favored 'General case' 0 C--N 1.348 0.523 0 C-N-CA 124.285 1.034 . . . . 0.0 109.702 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -91.08 119.45 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.402 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.508 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 43.0 mt-10 -128.19 162.71 26.34 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.144 0.978 . . . . 0.0 109.576 -178.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.503 ' HB3' HG12 ' A' ' 8' ' ' VAL . 87.7 m-85 -140.68 134.45 30.39 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.528 0.731 . . . . 0.0 110.147 -172.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -78.51 106.94 10.81 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 174.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.586 HD12 HD21 ' A' ' 40' ' ' LEU . 28.4 mt -87.98 123.35 32.6 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.351 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -78.11 99.45 6.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.534 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 63.0 m95 -63.88 126.26 27.05 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 171.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.575 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 38.0 ttpt -51.21 -54.44 25.59 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.411 1.484 . . . . 0.0 113.516 -164.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.75 30.69 9.78 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 116.78 -0.191 . . . . 0.0 112.855 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.534 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.6 m-85 -135.55 142.21 45.33 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.375 0.67 . . . . 0.0 110.234 -178.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.8 p -64.75 159.24 22.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.251 1.02 . . . . 0.0 112.141 -175.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.23 -34.81 78.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.298 0.639 . . . . 0.0 112.064 -177.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.82 -19.3 64.27 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.424 0.69 . . . . 0.0 111.546 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -99.82 -18.4 17.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.452 1.101 . . . . 0.0 110.844 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.479 ' HB3' ' O ' ' A' ' 22' ' ' LEU . 11.8 m120 -68.11 146.61 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.195 0.598 . . . . 0.0 111.183 175.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 42.7 p -126.07 165.06 19.54 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.32 0.648 . . . . 0.0 112.358 -166.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -88.4 116.9 26.95 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.993 0.917 . . . . 0.0 109.847 173.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -121.8 133.62 24.35 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 123.688 0.795 . . . . 0.0 110.744 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 58.2 Cg_endo -69.26 156.07 65.72 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.591 2.194 . . . . 0.0 111.667 176.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.421 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -51.49 -30.16 19.08 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.367 1.067 . . . . 0.0 113.43 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.42 -37.91 80.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.336 0.654 . . . . 0.0 110.983 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -89.83 3.26 53.49 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.491 0.717 . . . . 0.0 111.1 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.586 HD21 HD12 ' A' ' 22' ' ' LEU . 10.8 mt -88.66 124.25 33.9 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.45 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 32.5 t70 -84.1 -33.57 24.32 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 175.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.545 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 17.6 p -71.57 109.44 5.52 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 124.403 1.081 . . . . 0.0 110.839 174.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 73.4 Cg_endo -87.12 -19.39 2.52 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.253 1.968 . . . . 0.0 111.953 170.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.57 -35.58 60.57 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.932 0.893 . . . . 0.0 110.789 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.2 mt -69.98 -32.63 70.94 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.614 0.366 . . . . 0.0 110.865 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 29.3 mt -68.49 -46.56 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.13 -45.23 94.36 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.51 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.74 -32.14 73.25 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.173 0.589 . . . . 0.0 111.627 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.45 -40.19 96.48 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.85 0.86 . . . . 0.0 110.501 173.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.477 HD23 ' NH2' ' A' ' 11' ' ' ARG . 91.4 mt -73.22 -34.79 66.11 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.363 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 91.0 m-20 -76.7 -14.97 59.91 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.835 0.854 . . . . 0.0 111.084 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.3 t . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.868 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.545 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 46.1 tt0 . . . . . 0 CA--C 1.553 1.079 0 CA-C-O 122.227 1.013 . . . . 0.0 108.563 . . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 21.8 p -96.27 179.42 5.05 Favored 'General case' 0 C--O 1.246 0.92 0 C-N-CA 124.284 1.033 . . . . 0.0 111.55 -176.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -176.97 179.97 0.98 Allowed 'General case' 0 C--O 1.246 0.912 0 C-N-CA 125.336 1.454 . . . . 0.0 108.71 177.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.1 ttp85 . . . . . 0 N--CA 1.471 0.601 0 C-N-CA 123.805 0.842 . . . . 0.0 108.839 -179.561 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.4 HG12 ' HB3' ' A' ' 25' ' ' LYS . 6.0 p -75.65 122.5 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -97.26 134.9 33.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 123.657 0.783 . . . . 0.0 109.427 175.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.0 -55.98 9.18 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.003 0.921 . . . . 0.0 109.752 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -162.92 166.75 23.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.443 0.697 . . . . 0.0 110.875 -174.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.0 t -90.41 142.34 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 169.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.7 mt -106.77 -45.58 4.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.707 0.803 . . . . 0.0 111.058 -178.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -149.6 161.85 41.35 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.811 0.339 . . . . 0.0 110.933 -175.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -122.42 151.87 40.8 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.092 1.357 . . . . 0.0 108.605 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -153.23 163.58 39.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.123 0.569 . . . . 0.0 110.272 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.2 t -117.59 115.11 47.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 123.961 0.904 . . . . 0.0 109.178 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.41 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 88.6 t -116.45 109.85 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.362 1.065 . . . . 0.0 109.47 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.8 m120 60.93 17.92 8.32 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 124.303 1.041 . . . . 0.0 112.851 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.91 -24.38 14.93 Favored Glycine 0 C--N 1.347 1.159 0 CA-C-O 119.829 -0.428 . . . . 0.0 113.367 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptmt -81.92 170.98 14.99 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.951 0.5 . . . . 0.0 109.823 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -120.54 118.57 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.229 0.612 . . . . 0.0 110.214 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 61.6 mt-10 -111.02 152.23 27.09 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.809 0.844 . . . . 0.0 110.687 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.426 ' HE1' ' HB3' ' A' ' 37' ' ' GLU . 94.0 m-85 -130.09 126.9 38.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.651 1.18 . . . . 0.0 109.268 -176.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -78.32 108.35 11.6 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.447 HD11 HD21 ' A' ' 40' ' ' LEU . 39.9 mt -90.29 122.39 33.15 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 -174.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.37 96.79 6.11 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 163.189 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.544 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.5 m95 -67.88 135.27 52.23 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.364 0.415 . . . . 0.0 110.241 179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.4 ' HB3' HG12 ' A' ' 4' ' ' VAL . 24.9 ttmm -69.92 131.25 44.13 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 175.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.9 -35.27 3.82 Favored Glycine 0 C--N 1.347 1.145 0 O-C-N 123.314 0.384 . . . . 0.0 112.903 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.544 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 64.6 m-85 -91.65 144.74 25.21 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.636 0.775 . . . . 0.0 109.875 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.1 p -73.77 163.37 28.05 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.861 0.864 . . . . 0.0 112.1 -174.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.425 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.9 p-10 -59.55 -33.76 71.82 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.846 0.858 . . . . 0.0 111.389 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.03 -28.1 60.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.846 0.858 . . . . 0.0 111.839 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -88.51 -11.87 44.53 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.491 0.716 . . . . 0.0 111.25 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.542 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.8 m120 -63.25 157.66 22.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.1 p -143.65 154.67 43.76 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.488 0.715 . . . . 0.0 111.403 -172.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -77.54 124.02 27.37 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.899 0.88 . . . . 0.0 109.139 171.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -124.68 129.63 24.55 Favored Pre-proline 0 N--CA 1.468 0.458 0 C-N-CA 123.15 0.58 . . . . 0.0 110.761 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.584 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 51.4 Cg_endo -66.7 159.82 49.35 Favored 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.685 2.257 . . . . 0.0 111.91 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.426 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -64.69 -24.77 67.68 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.551 0.74 . . . . 0.0 112.786 -176.277 . . . . . . . . 3 3 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.02 -31.45 72.64 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.961 0.904 . . . . 0.0 110.624 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.03 -12.86 32.02 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.525 1.13 . . . . 0.0 111.216 -172.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.447 HD21 HD11 ' A' ' 22' ' ' LEU . 21.5 mt -86.53 120.97 28.43 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.502 0.721 . . . . 0.0 110.346 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . 0.477 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 26.9 t70 -83.08 -30.1 28.26 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 173.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.1 p -78.23 106.29 3.87 Favored Pre-proline 0 CA--C 1.559 1.319 0 C-N-CA 124.8 1.24 . . . . 0.0 112.164 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 64.8 Cg_endo -87.96 -18.51 2.31 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.736 2.291 . . . . 0.0 113.064 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . 0.422 ' HB3' ' OE1' ' B' ' 5' ' ' GLN . 35.2 tt0 -75.25 -36.22 61.3 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.722 0.809 . . . . 0.0 110.441 -174.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -67.22 -39.7 86.3 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.113 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.494 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 62.7 mt -63.39 -47.55 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 176.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.97 -53.27 60.25 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.264 1.026 . . . . 0.0 111.296 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.92 -33.63 74.6 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.609 0.764 . . . . 0.0 111.109 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -71.34 -36.87 71.69 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.169 0.988 . . . . 0.0 111.421 176.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 96.8 mt -67.83 -36.72 80.85 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 176.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -67.27 -28.41 68.01 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.256 1.022 . . . . 0.0 110.529 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 N--CA 1.481 1.101 0 C-N-CA 123.198 0.599 . . . . 0.0 110.557 175.58 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.422 ' OE1' ' HB3' ' A' ' 44' ' ' GLU . 33.3 mm-40 . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 120.79 0.329 . . . . 0.0 111.053 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 8.8 t -127.22 159.87 32.99 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 123.81 0.844 . . . . 0.0 110.43 -173.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -156.55 163.83 38.92 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.987 1.315 . . . . 0.0 108.094 173.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.463 ' HD2' ' N ' ' B' ' 8' ' ' ARG . 1.8 mpt_? . . . . . 0 N--CA 1.473 0.679 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.469 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 18.9 t -78.44 134.0 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 122.75 0.42 . . . . 0.0 110.613 -174.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.441 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -112.92 135.82 51.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.865 1.266 . . . . 0.0 110.285 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.681 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 18.1 tp10 -70.05 -54.82 11.42 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.924 1.29 . . . . 0.0 110.962 175.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.681 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.19 169.08 5.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.034 0.934 . . . . 0.0 111.104 170.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.5 t -77.16 141.26 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.966 172.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.1 mt -109.34 -41.15 4.71 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.645 0.778 . . . . 0.0 111.179 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -147.12 164.28 33.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.886 0.474 . . . . 0.0 110.322 -169.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -132.89 151.63 52.0 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.423 1.089 . . . . 0.0 110.137 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -148.68 163.89 35.96 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.219 1.007 . . . . 0.0 109.522 174.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 17' ' ' LYS . 57.0 t -115.99 108.37 24.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 170.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.1 t -91.34 110.2 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.5 m120 66.68 -73.3 0.08 Allowed 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.955 1.302 . . . . 0.0 111.201 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -160.26 34.66 0.43 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 175.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' A' ' 13' ' ' VAL . 12.4 ptmt -130.82 151.54 51.14 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.469 0.708 . . . . 0.0 109.601 177.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 95.3 t -90.54 130.15 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 122.634 0.374 . . . . 0.0 110.19 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 25.9 mt-10 -124.97 149.05 48.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 109.739 170.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.493 ' HB2' HD11 ' A' ' 40' ' ' LEU . 92.4 m-85 -122.93 132.59 54.23 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.22 1.008 . . . . 0.0 110.026 -178.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -78.12 109.38 12.16 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.194 0.997 . . . . 0.0 108.778 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.486 HD13 HD22 ' A' ' 40' ' ' LEU . 20.6 mt -88.81 126.07 35.19 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.06 0.544 . . . . 0.0 111.139 -176.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -80.0 107.43 12.78 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 162.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.522 ' CD1' ' HA ' ' A' ' 32' ' ' ASN . 90.3 m95 -72.33 134.38 45.46 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.591 0.356 . . . . 0.0 110.795 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -69.83 -60.78 2.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.844 0.858 . . . . 0.0 111.158 -173.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.76 32.84 6.38 Favored Glycine 0 C--N 1.344 0.976 0 CA-C-N 115.774 -0.648 . . . . 0.0 113.321 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.405 ' HD2' ' HB3' ' A' ' 24' ' ' TRP . 85.4 m-85 -137.27 163.91 29.8 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.124 0.969 . . . . 0.0 108.689 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.7 t -72.57 164.96 25.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.096 0.558 . . . . 0.0 111.619 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -73.12 -42.95 62.36 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.662 0.785 . . . . 0.0 112.692 -165.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.53 -13.66 60.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.986 0.515 . . . . 0.0 111.858 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -79.35 -10.89 59.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.218 1.007 . . . . 0.0 111.994 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.522 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 9.9 m120 -64.99 136.13 56.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.117 0.567 . . . . 0.0 112.319 -174.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.3 p -138.4 162.29 34.79 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.249 0.62 . . . . 0.0 112.341 -165.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -79.0 123.11 26.98 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.515 1.126 . . . . 0.0 111.123 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 57.2 mm-40 -121.65 135.1 24.88 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 171.913 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.45 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 38.5 Cg_endo -65.35 155.87 66.33 Favored 'Trans proline' 0 C--N 1.372 1.764 0 C-N-CA 122.329 2.019 . . . . 0.0 111.333 175.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -26.24 62.13 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.74 0.816 . . . . 0.0 112.502 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.412 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 10.4 pt-20 -71.64 -27.94 63.43 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.451 0.701 . . . . 0.0 110.841 178.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.486 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.7 m-20 -88.7 -16.37 32.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.924 0.89 . . . . 0.0 111.43 177.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 20' ' ' TYR . 23.6 mt -77.28 124.9 28.48 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.723 0.409 . . . . 0.0 110.362 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.97 24.0 12.82 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 p -121.29 89.11 46.45 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 123.652 0.781 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . 0.409 ' HD2' HE22 ' B' ' 5' ' ' GLN . 29.0 Cg_exo -65.35 -48.17 3.64 Favored 'Trans proline' 0 C--N 1.376 1.982 0 C-N-CA 123.063 2.509 . . . . 0.0 113.736 -177.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -64.42 -29.57 70.62 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.696 0.799 . . . . 0.0 112.165 -173.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 7' ' ' LYS . 53.1 mt -78.04 -35.84 49.24 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.399 0.68 . . . . 0.0 111.426 -176.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 71.6 mt -65.2 -47.51 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.41 -46.02 80.39 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.191 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.13 84.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.028 0.931 . . . . 0.0 110.923 -176.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -68.16 -46.35 71.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.918 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.23 -24.25 63.06 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.321 0.649 . . . . 0.0 110.178 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -74.78 -25.75 59.28 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.622 1.169 . . . . 0.0 109.853 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 CA--C 1.548 0.9 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.52 172.924 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.409 HE22 ' HD2' ' A' ' 43' ' ' PRO . 16.0 mm-40 . . . . . 0 CA--C 1.532 0.272 0 CA-C-O 120.961 0.41 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.469 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 10.1 t -131.94 179.12 6.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.349 -165.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.89 -179.61 8.22 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.84 0.856 . . . . 0.0 110.635 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.486 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 76.6 ttt180 . . . . . 0 N--CA 1.471 0.624 0 C-N-CA 125.082 1.353 . . . . 0.0 107.698 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 30.6 m -73.45 134.86 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.567 0.747 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.415 HG23 HD21 ' A' ' 22' ' ' LEU . 1.7 p -125.79 133.5 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.511 0.724 . . . . 0.0 110.014 174.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.805 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 10.6 tp10 -56.11 -64.84 0.73 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.364 1.466 . . . . 0.0 110.58 172.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.805 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.83 170.12 4.68 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.313 1.045 . . . . 0.0 110.689 169.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 49' ' ' PHE . 63.4 t -66.07 139.55 21.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.07 172.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . 0.438 HD12 ' HB2' ' A' ' 23' ' ' LYS . 86.3 mt -111.63 -30.14 7.46 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 123.78 0.832 . . . . 0.0 110.865 -177.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -159.43 163.39 35.46 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.638 0.375 . . . . 0.0 110.702 -172.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -136.33 147.69 47.53 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.103 0.961 . . . . 0.0 110.397 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -151.09 172.72 15.32 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.473 1.109 . . . . 0.0 108.821 174.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -129.98 118.54 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.518 0.727 . . . . 0.0 109.273 174.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.1 t -125.98 123.82 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.078 0.951 . . . . 0.0 109.335 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.9 m120 62.99 26.72 15.64 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.763 1.225 . . . . 0.0 111.969 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.76 -23.5 30.48 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.269 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -77.66 148.95 34.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.711 1.205 . . . . 0.0 109.458 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.9 t -106.12 116.06 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.637 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -104.41 154.62 19.63 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 110.261 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -138.48 124.27 19.86 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.484 1.114 . . . . 0.0 109.519 -175.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -78.5 109.3 12.55 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.415 HD21 HG23 ' A' ' 5' ' ' VAL . 54.2 mt -96.36 127.66 42.56 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.613 0.765 . . . . 0.0 111.209 -172.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.438 ' HB2' HD12 ' A' ' 9' ' ' LEU . 3.4 tmtp? -80.11 96.87 6.63 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 167.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.554 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 92.5 m95 -63.95 117.58 7.22 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 ttpp -66.11 -34.19 77.5 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 124.22 0.95 . . . . 0.0 111.829 -168.571 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.73 16.95 60.13 Favored Glycine 0 C--N 1.343 0.965 0 CA-C-N 115.977 -0.556 . . . . 0.0 113.604 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 98.7 m-85 -139.01 157.57 45.76 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.662 0.785 . . . . 0.0 110.058 -177.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 t -69.09 162.54 26.73 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.274 0.63 . . . . 0.0 111.865 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.68 -34.42 78.17 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.854 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.87 -22.34 60.79 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.088 0.555 . . . . 0.0 111.663 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -88.72 -3.78 58.69 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.833 0.853 . . . . 0.0 110.883 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.554 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.7 m120 -70.03 138.35 52.07 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.06 0.544 . . . . 0.0 111.079 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.0 p -130.36 165.26 22.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.37 0.668 . . . . 0.0 111.821 -170.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -83.95 116.41 22.78 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.059 0.944 . . . . 0.0 110.146 173.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -117.14 131.56 23.94 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 123.074 0.549 . . . . 0.0 110.116 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.637 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.5 Cg_endo -66.5 165.3 25.56 Favored 'Trans proline' 0 C--N 1.367 1.542 0 C-N-CA 122.392 2.061 . . . . 0.0 113.001 175.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.429 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.22 -29.14 67.3 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.255 1.022 . . . . 0.0 112.546 -178.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.35 -34.03 76.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.749 0.819 . . . . 0.0 110.984 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -77.11 -33.64 56.86 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.568 0.747 . . . . 0.0 111.156 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.429 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 34.9 mt -62.08 124.98 22.3 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.517 0.327 . . . . 0.0 111.259 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -108.23 19.54 19.77 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 122.653 1.216 . . . . 0.0 108.151 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.432 ' O ' HG13 ' A' ' 46' ' ' ILE . 12.9 p -127.69 87.52 55.75 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.398 -176.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.87 -27.32 26.11 Favored 'Trans proline' 0 C--N 1.377 2.058 0 C-N-CA 122.491 2.127 . . . . 0.0 111.786 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.15 -38.64 82.36 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.696 0.798 . . . . 0.0 111.187 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.513 HD13 ' HA ' ' A' ' 7' ' ' LYS . 77.6 mt -78.73 -23.59 45.37 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.259 0.624 . . . . 0.0 111.312 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 42' ' ' CYS . 79.9 mt -67.3 -52.39 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 169.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.16 -44.8 79.63 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.401 1.081 . . . . 0.0 110.994 177.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.52 -43.98 97.89 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.64 -177.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.468 ' HB2' ' HB ' ' A' ' 8' ' ' VAL . 43.4 t80 -59.43 -47.86 83.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 124.282 0.988 . . . . 0.0 111.102 177.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.42 -38.59 84.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.442 0.697 . . . . 0.0 110.548 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.91 -24.63 59.72 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.616 0.766 . . . . 0.0 111.284 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 52.5 m . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 123.266 0.626 . . . . 0.0 111.388 178.827 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 42.8 p -93.2 170.89 9.29 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 122.492 1.139 . . . . 0.0 113.808 -164.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.27 -179.82 7.67 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-N 113.737 -1.574 . . . . 0.0 108.692 172.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 . . . . . 0 N--CA 1.467 0.422 0 C-N-CA 123.601 0.761 . . . . 0.0 109.716 -175.798 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.2 t -75.83 130.55 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.502 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -106.57 119.61 56.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.292 0.637 . . . . 0.0 109.927 174.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.434 ' HG3' ' HG2' ' A' ' 7' ' ' LYS . 11.7 tp10 -48.35 -57.17 6.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.747 1.619 . . . . 0.0 110.989 172.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.434 ' HG2' ' HG3' ' A' ' 6' ' ' GLU . 3.6 ptpp? -170.36 156.94 5.87 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.72 0.808 . . . . 0.0 110.929 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 20' ' ' TYR . 85.3 t -71.85 120.27 19.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.869 169.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -87.75 -49.42 7.14 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.265 0.626 . . . . 0.0 110.841 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -147.8 164.88 32.25 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 -170.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -137.54 134.73 36.01 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.286 1.034 . . . . 0.0 109.605 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -138.52 175.75 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.325 0.65 . . . . 0.0 109.907 177.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -123.18 123.67 68.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 108.452 174.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 75.9 t -133.64 122.05 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.766 0.826 . . . . 0.0 109.175 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 66.54 19.67 10.85 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.928 1.291 . . . . 0.0 111.694 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.8 -19.74 53.11 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.923 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -81.66 166.28 20.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.831 0.453 . . . . 0.0 109.85 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.8 t -114.42 110.55 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 123.774 0.83 . . . . 0.0 108.911 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.528 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 95.7 mt-10 -104.53 156.1 18.24 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.62 0.768 . . . . 0.0 110.475 -177.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.43 ' HB3' HG13 ' A' ' 8' ' ' VAL . 48.0 m-85 -134.9 124.06 24.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.391 1.077 . . . . 0.0 108.444 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -76.72 107.68 9.2 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.532 HD13 HD21 ' A' ' 40' ' ' LEU . 43.0 mt -92.65 123.69 36.12 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.344 -174.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -77.38 98.97 5.42 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.607 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 82.9 m95 -67.54 122.01 17.08 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 173.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -66.7 -26.99 67.28 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 123.643 0.589 . . . . 0.0 111.905 -175.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.28 -7.8 82.35 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-N 116.379 -0.373 . . . . 0.0 113.661 179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -129.44 162.84 27.16 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.593 0.757 . . . . 0.0 110.784 -174.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.8 p -73.14 161.63 30.38 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.387 0.675 . . . . 0.0 110.861 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.478 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 21.0 m-20 -57.8 -36.39 72.14 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.576 0.547 . . . . 0.0 110.999 177.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.88 -18.0 60.5 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.034 0.934 . . . . 0.0 112.542 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -99.12 -8.1 25.69 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.408 0.283 . . . . 0.0 111.365 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.607 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.9 m120 -65.74 158.55 27.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.452 0.701 . . . . 0.0 112.584 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.0 p -140.76 158.76 43.49 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 121.403 0.621 . . . . 0.0 112.304 -173.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -80.67 123.24 28.0 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.862 1.265 . . . . 0.0 109.828 173.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -123.3 133.41 24.52 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 122.849 0.46 . . . . 0.0 110.142 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.528 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 56.0 Cg_endo -66.98 156.97 63.92 Favored 'Trans proline' 0 C--N 1.371 1.747 0 C-N-CA 122.911 2.407 . . . . 0.0 112.12 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.405 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -56.52 -31.32 63.99 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.852 0.861 . . . . 0.0 113.1 -176.779 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.66 -28.21 68.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.258 1.023 . . . . 0.0 111.736 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.433 ' OD1' ' HB3' ' B' ' 8' ' ' ARG . 57.0 t30 -89.47 -15.23 33.56 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.463 1.105 . . . . 0.0 111.082 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.532 HD21 HD13 ' A' ' 22' ' ' LEU . 28.5 mt -79.04 130.3 35.37 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.099 0.56 . . . . 0.0 110.961 -173.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -105.6 12.53 31.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.891 0.877 . . . . 0.0 109.763 175.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.5 p -113.16 90.3 16.07 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.234 1.014 . . . . 0.0 109.166 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.51 -29.53 1.81 Allowed 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.607 2.205 . . . . 0.0 112.958 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.92 -29.34 61.99 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.481 0.712 . . . . 0.0 111.122 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.402 ' HB3' HG21 ' A' ' 8' ' ' VAL . 32.6 mt -68.37 -30.09 68.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.528 0.331 . . . . 0.0 111.605 175.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 47.8 mm -71.71 -47.83 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.362 0.414 . . . . 0.0 110.343 176.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -54.96 -50.2 69.5 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.819 0.699 . . . . 0.0 110.386 174.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.36 -50.71 72.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.763 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -55.85 -50.86 69.43 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.254 1.022 . . . . 0.0 111.756 -178.425 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.43 -47.5 78.89 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.606 0.762 . . . . 0.0 111.128 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -66.16 -23.17 66.42 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.577 0.751 . . . . 0.0 111.524 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 N--CA 1.477 0.877 0 C-N-CA 123.374 0.67 . . . . 0.0 112.482 -178.922 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 21.8 p -134.51 169.83 16.68 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.75 0.82 . . . . 0.0 110.738 -170.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -168.26 165.39 13.04 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.864 0.866 . . . . 0.0 109.583 173.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.433 ' HB3' ' OD1' ' A' ' 39' ' ' ASN . 38.4 ttm-85 . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . 0.458 ' HD2' ' HA ' ' B' ' 8' ' ' ARG . 67.4 m-85 . . . . . 0 C--O 1.244 0.775 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 . . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.29 115.54 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.04 -177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.552 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.1 p -98.57 130.66 47.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 124.212 1.005 . . . . 0.0 109.292 171.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.83 -62.38 1.9 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.628 0.771 . . . . 0.0 109.912 173.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -165.71 168.88 15.75 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.458 0.646 . . . . 0.0 110.943 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.407 HG13 ' HB3' ' A' ' 20' ' ' TYR . 77.8 t -74.1 136.23 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.056 170.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.9 mt -103.0 -36.18 8.28 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.41 0.684 . . . . 0.0 110.201 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -156.12 162.74 40.2 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.27 -173.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -124.13 143.94 50.19 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.573 1.149 . . . . 0.0 109.344 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -137.78 164.76 28.11 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.728 0.811 . . . . 0.0 109.588 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.472 HG23 HG23 ' A' ' 18' ' ' VAL . 59.2 t -123.8 106.13 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 169.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.3 t -85.62 102.92 11.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 172.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 68.22 -76.08 0.06 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.257 1.423 . . . . 0.0 110.813 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.51 -10.29 0.82 Allowed Glycine 0 N--CA 1.477 1.409 0 C-N-CA 123.401 0.524 . . . . 0.0 112.833 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.53 ' HD2' ' HB3' ' A' ' 36' ' ' PRO . 18.7 ttpt -95.83 146.08 24.84 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.978 1.311 . . . . 0.0 109.319 -179.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.472 HG23 HG23 ' A' ' 13' ' ' VAL . 85.9 t -98.5 129.35 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.843 0.857 . . . . 0.0 109.822 177.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -121.07 148.05 44.69 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.407 ' HB3' HG13 ' A' ' 8' ' ' VAL . 88.5 m-85 -116.96 135.82 53.41 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.138 0.975 . . . . 0.0 109.551 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -78.64 106.78 10.86 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.467 HD22 HG21 ' A' ' 5' ' ' VAL . 27.0 mt -92.73 115.55 28.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.57 -173.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -76.73 108.94 10.11 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 166.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.552 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 81.4 m95 -75.17 123.44 25.26 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.444 0.465 . . . . 0.0 109.818 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -63.76 -48.34 77.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.946 0.898 . . . . 0.0 111.72 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.06 2.5 88.25 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.292 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.529 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 76.9 m-85 -128.69 171.18 12.44 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.965 0.906 . . . . 0.0 109.879 -176.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 82.2 p -80.55 166.12 21.46 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -174.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -68.64 -27.95 66.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.098 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.2 -16.66 64.07 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.585 0.754 . . . . 0.0 111.256 174.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.24 -1.29 21.94 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.739 0.815 . . . . 0.0 111.208 -175.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -58.81 126.33 27.2 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.328 0.651 . . . . 0.0 111.351 175.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.4 p -129.06 150.63 50.37 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.049 0.54 . . . . 0.0 111.377 -174.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -76.94 118.25 19.33 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.792 0.837 . . . . 0.0 109.978 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -119.8 135.78 24.43 Favored Pre-proline 0 N--CA 1.471 0.593 0 C-N-CA 122.645 0.378 . . . . 0.0 110.249 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.53 ' HB3' ' HD2' ' A' ' 17' ' ' LYS . 37.1 Cg_endo -64.71 159.57 44.61 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.7 2.267 . . . . 0.0 113.667 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -54.69 -37.2 65.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.114 1.366 . . . . 0.0 111.858 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -72.98 -22.14 60.74 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.836 1.254 . . . . 0.0 111.602 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -90.79 -17.72 26.15 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 124.327 1.051 . . . . 0.0 110.825 -175.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.457 HD21 HD13 ' A' ' 22' ' ' LEU . 11.1 mt -76.84 129.88 36.85 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.117 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -104.82 17.67 23.7 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 170.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 40' ' ' LEU . 10.8 p -116.71 90.03 30.28 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.601 1.16 . . . . 0.0 109.629 -175.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -80.71 -27.49 3.19 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 122.748 2.299 . . . . 0.0 112.857 -178.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -27.79 61.71 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.39 0.676 . . . . 0.0 110.366 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.468 HD23 ' HG2' ' B' ' 5' ' ' GLN . 34.5 mt -71.73 -40.01 69.72 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.268 0.355 . . . . 0.0 111.088 174.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.51 -43.61 98.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.87 -45.96 80.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.598 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.32 -31.8 73.12 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.144 -176.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -62.1 -47.87 82.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.638 0.775 . . . . 0.0 110.167 175.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 98.7 mt -62.34 -45.95 90.88 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.3 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -68.15 -24.88 65.04 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.386 0.674 . . . . 0.0 111.327 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 N--CA 1.476 0.827 0 C-N-CA 123.072 0.549 . . . . 0.0 110.664 -176.978 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.518 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.47 0.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 . . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 4.2 t -85.77 138.67 31.92 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.978 0.894 . . . . 0.0 112.577 -168.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -154.45 160.12 41.43 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 124.819 1.247 . . . . 0.0 108.166 170.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.458 ' HA ' ' HD2' ' A' ' 3' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--O 1.243 0.756 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.092 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 . . . . . 0 N--CA 1.481 1.112 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.49 134.68 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-O 120.846 0.355 . . . . 0.0 110.063 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.416 HG23 HD21 ' A' ' 22' ' ' LEU . 2.3 p -116.09 132.9 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.935 0.894 . . . . 0.0 109.966 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -63.51 -57.73 9.27 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.388 1.075 . . . . 0.0 109.351 174.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -171.88 168.44 6.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.116 0.966 . . . . 0.0 111.031 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.427 HG12 ' HB3' ' A' ' 20' ' ' TYR . 58.5 t -79.11 144.23 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 123.591 0.756 . . . . 0.0 109.482 172.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.6 mt -108.45 -43.34 4.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.286 1.034 . . . . 0.0 111.097 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.65 164.75 35.32 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.171 0.589 . . . . 0.0 110.081 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -129.74 144.52 51.33 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.234 1.014 . . . . 0.0 110.145 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -141.41 167.26 22.59 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.393 1.077 . . . . 0.0 109.953 176.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 17' ' ' LYS . 49.1 t -126.4 108.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 168.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.27 126.46 61.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 66.55 -71.7 0.09 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.004 1.321 . . . . 0.0 111.123 -174.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.85 15.96 0.1 OUTLIER Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.914 176.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 13' ' ' VAL . 13.7 ptpt -118.33 159.42 23.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.694 0.797 . . . . 0.0 109.711 -179.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.8 t -101.29 118.84 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 123.237 0.615 . . . . 0.0 110.351 -179.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.728 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 38.8 mt-10 -104.88 161.25 14.35 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 121.604 0.716 . . . . 0.0 111.885 169.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.427 ' HB3' HG12 ' A' ' 8' ' ' VAL . 97.0 m-85 -135.69 128.17 30.51 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.036 1.334 . . . . 0.0 108.793 -177.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -77.67 107.24 10.02 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.416 HD21 HG23 ' A' ' 5' ' ' VAL . 18.6 mt -91.17 122.38 33.76 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 122.38 0.272 . . . . 0.0 111.217 -172.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -77.26 103.36 7.15 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 164.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.477 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 94.1 m95 -73.04 139.77 46.8 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 122.613 0.365 . . . . 0.0 110.497 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -90.57 120.14 31.41 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.556 0.742 . . . . 0.0 109.173 -175.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.28 -35.23 4.71 Favored Glycine 0 N--CA 1.472 1.1 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 -175.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.477 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 65.2 m-85 -80.74 162.31 24.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.108 0.963 . . . . 0.0 109.851 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.4 p -82.38 173.09 12.36 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.849 0.46 . . . . 0.0 110.923 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.21 -16.84 62.53 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.97 0.508 . . . . 0.0 111.686 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.86 -19.66 60.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.412 0.685 . . . . 0.0 111.107 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -88.16 -19.1 27.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.328 0.651 . . . . 0.0 111.54 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -52.76 121.72 7.76 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 123.718 0.636 . . . . 0.0 111.774 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.41 158.47 44.34 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.83 0.852 . . . . 0.0 110.996 -172.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.48 109.74 16.98 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.752 0.821 . . . . 0.0 110.63 -178.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -112.39 124.66 31.53 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.144 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.728 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 27.7 Cg_endo -63.18 161.94 28.39 Favored 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.772 2.315 . . . . 0.0 112.589 175.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -29.36 35.15 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.426 1.09 . . . . 0.0 112.42 178.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.464 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.5 pt-20 -67.2 -31.34 71.65 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.068 0.947 . . . . 0.0 111.044 178.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -80.31 -30.18 38.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.927 0.891 . . . . 0.0 111.114 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.409 HD22 HD11 ' A' ' 22' ' ' LEU . 13.5 mt -73.14 116.06 13.22 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.556 0.342 . . . . 0.0 110.325 -174.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -87.22 -7.57 57.77 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.5 ' HA ' ' HG2' ' B' ' 5' ' ' GLN . 12.7 p -92.81 98.81 2.44 Favored Pre-proline 0 C--N 1.354 0.777 0 C-N-CA 125.034 1.334 . . . . 0.0 110.8 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.36 -26.51 8.76 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.21 1.94 . . . . 0.0 111.546 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -77.88 -30.3 50.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.875 1.27 . . . . 0.0 111.606 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 59.5 mt -77.16 -27.4 53.75 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.522 0.329 . . . . 0.0 111.359 177.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.409 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 58.1 mt -68.2 -53.05 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 172.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.05 -51.89 68.09 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.406 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -42.26 91.22 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 124.041 0.838 . . . . 0.0 111.362 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -60.07 -48.37 82.01 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 0.0 110.942 175.984 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 72.9 mt -65.81 -25.9 67.44 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.35 0.66 . . . . 0.0 111.218 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -80.44 -27.18 38.02 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.567 0.747 . . . . 0.0 111.592 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 121.457 0.646 . . . . 0.0 109.974 -179.135 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.5 ' HG2' ' HA ' ' A' ' 42' ' ' CYS . 5.8 tp60 . . . . . 0 N--CA 1.472 0.66 0 CA-C-O 120.925 0.393 . . . . 0.0 110.065 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.428 ' H ' ' HG3' ' B' ' 5' ' ' GLN . 11.5 t -100.7 177.22 5.06 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 122.333 1.063 . . . . 0.0 111.341 -176.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.24 163.89 39.08 Favored 'General case' 0 C--O 1.247 0.969 0 C-N-CA 125.566 1.546 . . . . 0.0 107.785 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 . . . . . 0 C--N 1.323 -0.569 0 C-N-CA 124.396 1.078 . . . . 0.0 108.47 -172.637 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 . . . . . 0 N--CA 1.472 0.637 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 16.8 m -83.22 136.41 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 122.74 0.416 . . . . 0.0 110.1 -178.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.448 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -117.25 129.68 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.935 0.894 . . . . 0.0 110.185 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -70.37 -56.69 6.07 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 124.464 1.106 . . . . 0.0 110.616 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -155.07 161.16 41.38 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.735 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.7 t -88.29 136.14 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-N 115.323 -0.853 . . . . 0.0 108.802 168.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -102.8 -50.7 3.47 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 110.696 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -150.75 168.09 25.45 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.283 0.633 . . . . 0.0 110.316 -169.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -134.2 142.81 47.53 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.543 1.137 . . . . 0.0 111.36 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -134.71 168.88 18.21 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.143 1.377 . . . . 0.0 108.756 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.92 110.78 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.43 0.692 . . . . 0.0 109.347 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 64.3 t -106.47 107.44 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.381 1.072 . . . . 0.0 110.066 176.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 57.24 43.31 23.93 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.77 1.228 . . . . 0.0 112.291 170.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.39 -25.2 23.84 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 115.614 -0.721 . . . . 0.0 113.226 177.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -91.24 151.45 20.92 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.102 0.961 . . . . 0.0 109.727 179.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.8 t -98.03 138.31 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.65 0.78 . . . . 0.0 109.743 177.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.562 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.2 mt-10 -121.28 166.48 13.96 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 167.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -137.1 152.52 50.1 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.576 1.15 . . . . 0.0 108.836 -177.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -92.5 109.28 20.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.489 HD11 HD21 ' A' ' 40' ' ' LEU . 10.4 mp -92.05 116.52 29.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.109 0.564 . . . . 0.0 110.844 -174.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tmtm? -76.36 99.66 4.91 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 105.695 -1.965 . . . . 0.0 105.695 165.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.638 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 94.2 m95 -70.16 135.17 48.87 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.421 0.451 . . . . 0.0 111.42 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -78.39 121.04 23.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.533 1.133 . . . . 0.0 109.923 -176.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.78 0.0 87.81 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 113.312 -176.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.448 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.8 m-85 -118.6 152.45 36.01 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.993 0.917 . . . . 0.0 110.044 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.0 t -77.66 163.66 26.0 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.401 0.68 . . . . 0.0 111.746 -173.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.42 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 m-20 -65.44 -31.69 72.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.752 0.821 . . . . 0.0 111.992 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.41 -18.75 65.23 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.502 0.721 . . . . 0.0 111.79 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -108.56 -5.64 16.42 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.169 0.987 . . . . 0.0 111.177 -176.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.638 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.6 m120 -66.37 132.7 48.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.582 0.353 . . . . 0.0 111.102 175.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 62.6 p -127.35 160.98 29.73 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.46 0.704 . . . . 0.0 111.41 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -84.45 122.66 29.29 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.998 175.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -120.9 137.61 26.73 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 123.012 0.525 . . . . 0.0 110.61 175.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.562 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 32.2 Cg_endo -64.05 161.54 33.03 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 122.397 2.065 . . . . 0.0 112.084 173.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -24.32 66.33 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.8 179.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.438 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 17.1 pt-20 -73.98 -22.44 59.62 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.732 0.813 . . . . 0.0 111.441 178.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -87.42 -15.94 36.3 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.423 0.689 . . . . 0.0 111.372 177.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.489 HD21 HD11 ' A' ' 22' ' ' LEU . 62.5 mt -72.85 116.39 13.29 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.595 0.358 . . . . 0.0 111.2 -176.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 6.81 42.98 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 18.4 p -106.36 92.68 7.18 Favored Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 125.264 1.425 . . . . 0.0 110.147 -178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -38.76 0.49 Allowed 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.605 2.203 . . . . 0.0 113.599 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.25 -21.21 59.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.815 0.446 . . . . 0.0 111.646 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.414 ' HG ' ' OE1' ' B' ' 5' ' ' GLN . 74.0 mt -73.25 -30.22 63.31 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.508 0.323 . . . . 0.0 111.275 174.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.4 mt -66.47 -46.53 86.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -62.86 -43.53 98.55 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.925 176.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.42 73.74 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.15 0.58 . . . . 0.0 110.915 -176.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -62.04 -43.57 98.56 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.059 0.944 . . . . 0.0 110.479 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.3 mt -71.18 -29.47 65.22 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.478 0.711 . . . . 0.0 110.291 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -76.55 -15.97 59.73 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.751 0.82 . . . . 0.0 111.189 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 29.7 m . . . . . 0 N--CA 1.478 0.963 0 C-N-CA 123.276 0.631 . . . . 0.0 110.393 172.799 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.414 ' OE1' ' HG ' ' A' ' 45' ' ' LEU . 5.3 tp-100 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 121.339 0.59 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 0.2 OUTLIER -128.04 176.66 7.45 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.456 -160.402 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -171.89 168.75 5.95 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.587 1.155 . . . . 0.0 109.473 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 . . . . . 0 N--CA 1.47 0.572 0 C-N-CA 124.145 0.978 . . . . 0.0 108.804 177.259 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.492 ' HA ' HG23 ' B' ' 6' ' ' THR . 7.5 p -83.35 136.41 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.306 0.574 . . . . 0.0 111.579 -173.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.461 HG23 HD21 ' A' ' 22' ' ' LEU . 1.5 p -118.02 126.84 75.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.253 1.021 . . . . 0.0 109.445 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.25 -51.82 68.32 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.188 1.395 . . . . 0.0 111.514 174.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -170.77 165.54 7.98 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.73 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.428 HG12 ' HD2' ' A' ' 20' ' ' TYR . 98.0 t -82.26 133.59 28.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.596 168.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.9 mt -99.98 -38.47 8.58 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.468 0.707 . . . . 0.0 110.429 -178.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -153.62 163.6 39.7 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.85 0.46 . . . . 0.0 110.575 -174.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.0 ttt-85 -132.57 145.06 50.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.721 1.209 . . . . 0.0 109.329 -178.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -144.63 163.26 34.48 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.861 0.864 . . . . 0.0 109.655 176.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.464 HG23 HG22 ' A' ' 18' ' ' VAL . 88.3 t -122.23 109.49 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.612 0.765 . . . . 0.0 108.941 175.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.2 t -113.54 115.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.649 1.179 . . . . 0.0 109.701 177.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 64.73 27.71 13.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.839 1.256 . . . . 0.0 112.012 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.15 -11.82 66.24 Favored Glycine 0 N--CA 1.472 1.071 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.121 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -86.3 146.42 26.51 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.464 HG22 HG23 ' A' ' 13' ' ' VAL . 98.4 t -107.16 121.92 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.32 0.648 . . . . 0.0 109.453 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.502 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 48.5 mt-10 -112.84 155.91 23.82 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.048 0.939 . . . . 0.0 109.597 177.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.428 ' HD2' HG12 ' A' ' 8' ' ' VAL . 96.4 m-85 -132.92 129.45 38.34 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.469 1.108 . . . . 0.0 108.711 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -76.88 107.76 9.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.461 HD21 HG23 ' A' ' 5' ' ' VAL . 16.6 mt -87.51 122.73 31.61 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.9 -175.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -76.24 93.17 3.36 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 165.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.543 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 85.6 m95 -65.22 117.61 8.05 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -70.54 -43.46 69.49 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.308 0.643 . . . . 0.0 110.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.16 13.6 64.48 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.895 -0.593 . . . . 0.0 113.784 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -136.78 161.69 35.28 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.159 0.984 . . . . 0.0 109.801 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.3 p -68.24 159.74 30.62 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.756 0.822 . . . . 0.0 111.795 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.51 -38.27 89.19 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.055 -174.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.66 -19.86 65.96 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.341 0.657 . . . . 0.0 111.877 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -96.43 -2.11 46.11 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 123.933 0.893 . . . . 0.0 110.868 -178.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.543 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 1.5 m120 -64.94 129.08 38.42 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.631 0.773 . . . . 0.0 110.394 172.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 p -138.64 158.72 43.72 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.305 0.642 . . . . 0.0 112.01 -169.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -80.79 121.07 25.47 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.636 1.174 . . . . 0.0 111.147 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.453 ' HB2' HD22 ' A' ' 40' ' ' LEU . 49.3 mm-40 -122.59 134.01 24.72 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 123.425 0.69 . . . . 0.0 110.552 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.502 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 69.7 Cg_endo -70.6 154.86 64.15 Favored 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.778 2.319 . . . . 0.0 111.813 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.29 -28.39 62.98 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.407 1.083 . . . . 0.0 113.31 -175.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.92 -37.71 82.0 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.066 0.946 . . . . 0.0 110.552 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -77.58 -23.21 50.02 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 110.604 -178.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.453 HD22 ' HB2' ' A' ' 35' ' ' GLU . 57.6 mt -75.02 137.41 41.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.939 -178.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -111.68 11.26 21.06 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.909 0.883 . . . . 0.0 109.643 176.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.2 p -115.54 90.96 27.52 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 123.813 0.845 . . . . 0.0 111.059 -175.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.31 -24.72 14.1 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.615 2.21 . . . . 0.0 111.897 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.84 -52.74 63.9 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.779 1.232 . . . . 0.0 110.926 176.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.16 -33.68 73.78 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.144 -175.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.4 -46.68 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 122.759 0.424 . . . . 0.0 110.391 178.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.9 -53.96 52.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.825 0.85 . . . . 0.0 110.522 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.57 -46.69 88.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.835 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -61.99 -52.41 64.11 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.067 0.947 . . . . 0.0 111.93 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.15 -33.6 73.66 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.435 0.694 . . . . 0.0 111.181 -177.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -75.38 -37.77 60.35 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.428 0.691 . . . . 0.0 111.491 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 61.8 m . . . . . 0 N--CA 1.486 1.36 0 C-N-CA 123.752 0.821 . . . . 0.0 112.234 -178.867 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 122.068 0.937 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.492 HG23 ' HA ' ' A' ' 4' ' ' VAL . 40.8 p -134.01 175.18 9.71 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.817 1.247 . . . . 0.0 110.135 -177.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.21 161.37 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.633 1.173 . . . . 0.0 109.964 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.492 ' HD2' ' H ' ' B' ' 8' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.272 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 174.351 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 66.7 t80 . . . . . 0 N--CA 1.475 0.799 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.544 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 4.2 p -69.72 126.92 30.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 CA-C-O 121.353 0.597 . . . . 0.0 112.284 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.451 HG21 HD22 ' A' ' 22' ' ' LEU . 2.1 p -99.84 120.14 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.474 ' HG2' ' HZ2' ' A' ' 7' ' ' LYS . 35.5 tt0 -53.27 -57.96 8.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.733 1.613 . . . . 0.0 111.726 174.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.474 ' HZ2' ' HG2' ' A' ' 6' ' ' GLU . 8.1 ptpp? -162.52 161.88 27.16 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.52 -174.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.5 t -85.49 130.65 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 168.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.7 mt -96.91 -38.54 9.78 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.887 0.875 . . . . 0.0 111.282 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -156.24 164.33 38.48 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.117 -169.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.513 ' HE ' HG13 ' A' ' 18' ' ' VAL . 41.8 ttt180 -134.94 144.33 47.39 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 0.0 110.577 -173.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -140.49 163.62 32.34 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.791 0.836 . . . . 0.0 109.798 176.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . 0.42 HG22 HG23 ' A' ' 18' ' ' VAL . 89.2 t -121.7 123.93 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . 0.434 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 2.6 p -139.21 123.25 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.032 0.933 . . . . 0.0 108.884 -177.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 60.77 22.49 12.48 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.276 1.03 . . . . 0.0 112.455 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.31 -8.15 77.61 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.878 -0.401 . . . . 0.0 113.994 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 15.0 ptpt -94.93 171.58 8.68 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.513 HG13 ' HE ' ' A' ' 11' ' ' ARG . 99.1 t -117.69 126.3 74.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 174.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.557 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 36.7 mt-10 -106.82 157.09 18.01 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.576 0.703 . . . . 0.0 109.721 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -126.61 127.44 45.23 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.441 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -77.06 108.85 10.43 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.451 HD22 HG21 ' A' ' 5' ' ' VAL . 49.8 mt -81.78 172.79 12.95 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.061 0.851 . . . . 0.0 111.102 -174.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -126.46 100.97 6.48 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.514 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 84.6 m95 -69.57 116.63 10.19 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -73.1 114.32 11.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 123.778 0.674 . . . . 0.0 110.173 -171.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 118.13 -29.26 6.56 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 -174.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -98.05 157.81 15.91 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.214 1.005 . . . . 0.0 111.256 179.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.1 t -74.26 160.77 30.66 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.598 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.471 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.7 m-20 -70.0 -19.04 63.35 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.147 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.02 -31.54 66.29 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.868 0.867 . . . . 0.0 110.578 173.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -78.79 -30.7 45.65 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.366 0.666 . . . . 0.0 110.978 -178.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.514 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.0 m120 -61.46 148.75 40.83 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.846 0.716 . . . . 0.0 112.423 -172.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.3 p -126.57 163.8 22.61 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.772 0.829 . . . . 0.0 111.286 -167.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.3 119.73 25.41 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 170.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -119.56 132.71 23.92 Favored Pre-proline 0 C--O 1.239 0.511 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 172.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.557 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 48.2 Cg_endo -67.11 160.0 49.46 Favored 'Trans proline' 0 C--N 1.366 1.455 0 C-N-CA 122.161 1.907 . . . . 0.0 112.333 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -55.69 -28.22 54.38 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.025 1.33 . . . . 0.0 112.204 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.467 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.0 pt-20 -75.5 -17.72 60.03 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.056 1.342 . . . . 0.0 111.731 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -107.97 -4.77 17.57 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.199 0.599 . . . . 0.0 111.331 -169.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.551 HD12 HD13 ' A' ' 46' ' ' ILE . 30.7 mt -87.05 158.2 19.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.15 0.58 . . . . 0.0 110.861 -177.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.54 9.76 25.23 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 166.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 23.0 p -117.43 90.61 35.28 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 123.069 0.548 . . . . 0.0 111.527 -172.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.75 -22.14 10.63 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.314 2.01 . . . . 0.0 111.079 166.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.28 -44.31 83.91 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.246 1.018 . . . . 0.0 111.593 177.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.81 -29.18 55.87 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.982 0.513 . . . . 0.0 110.963 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.551 HD13 HD12 ' A' ' 40' ' ' LEU . 72.0 mt -63.48 -54.28 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 172.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.51 -46.14 89.78 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.692 -176.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.2 90.2 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 123.747 0.655 . . . . 0.0 110.766 -177.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . 0.411 ' CE2' ' HB2' ' A' ' 11' ' ' ARG . 82.8 t80 -58.78 -48.5 81.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.044 0.538 . . . . 0.0 109.952 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.3 mt -65.56 -27.6 68.55 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.498 0.719 . . . . 0.0 111.557 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -82.5 -19.64 38.35 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.582 0.753 . . . . 0.0 111.981 175.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.5 m . . . . . 0 N--CA 1.48 1.035 0 C-N-CA 122.691 0.396 . . . . 0.0 110.321 177.585 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.52 0.2 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 76.1 p -99.33 177.71 5.11 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.016 0.912 . . . . 0.0 112.532 -171.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -163.84 156.36 17.64 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.267 174.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 123.249 0.62 . . . . 0.0 109.673 179.779 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 . . . . . 0 C--O 1.239 0.509 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.4 p -80.53 123.82 37.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-O 121.468 0.651 . . . . 0.0 109.562 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.505 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -102.97 133.45 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.412 1.085 . . . . 0.0 109.358 175.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.613 ' HB2' ' HG3' ' A' ' 25' ' ' LYS . 34.3 tt0 -69.55 -49.15 57.02 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.474 0.71 . . . . 0.0 111.01 176.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . 0.43 ' HA ' HD23 ' A' ' 45' ' ' LEU . 21.1 ptmt -166.61 164.92 16.93 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.633 0.583 . . . . 0.0 111.607 -173.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.439 HG13 ' HD2' ' A' ' 20' ' ' TYR . 94.7 t -85.51 135.76 24.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.0 mt -100.48 -43.64 6.15 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.736 0.814 . . . . 0.0 110.137 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -148.92 164.86 33.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.343 -171.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . 0.462 ' HE ' HG13 ' A' ' 18' ' ' VAL . 34.9 ttt180 -138.72 128.59 25.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.068 0.947 . . . . 0.0 109.485 -175.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -124.41 162.31 24.15 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.934 0.894 . . . . 0.0 109.35 175.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -126.31 112.45 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.966 0.906 . . . . 0.0 108.768 177.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.0 m -120.45 125.2 73.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.113 0.965 . . . . 0.0 109.401 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 61.61 20.84 11.63 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.226 1.01 . . . . 0.0 112.108 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.8 -24.04 32.76 Favored Glycine 0 C--N 1.348 1.211 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.448 -176.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.8 ptmt -82.54 163.35 21.58 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . 0.462 HG13 ' HE ' ' A' ' 11' ' ' ARG . 45.9 t -117.6 127.11 75.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 123.312 0.645 . . . . 0.0 110.186 -176.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 45.1 mt-10 -109.19 154.05 22.92 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.599 0.76 . . . . 0.0 109.586 170.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HD2' HG13 ' A' ' 8' ' ' VAL . 63.8 m-85 -128.04 128.51 45.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.435 1.094 . . . . 0.0 108.669 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -78.51 107.89 11.49 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.2 mt -92.84 119.86 32.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.345 -171.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -75.87 93.33 3.18 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 167.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.604 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 87.1 m95 -68.51 134.79 50.6 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 178.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.613 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 26.4 mttm -67.64 134.23 50.79 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.863 0.727 . . . . 0.0 110.19 172.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.19 -33.95 4.12 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.842 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.42 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 79.7 m-85 -91.43 149.48 21.69 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.048 0.939 . . . . 0.0 110.509 -177.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 p -70.54 160.98 31.47 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.934 0.894 . . . . 0.0 111.795 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . 0.468 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 p-10 -65.54 -29.94 70.62 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.341 1.057 . . . . 0.0 111.872 -177.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.8 -27.02 57.78 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.541 0.736 . . . . 0.0 111.19 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -89.04 -11.96 42.67 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.65 0.78 . . . . 0.0 110.83 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.604 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -64.26 143.07 58.16 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 122.529 0.332 . . . . 0.0 110.479 174.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 34.2 p -132.94 160.85 35.87 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.191 0.596 . . . . 0.0 111.876 -168.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -82.24 122.23 27.65 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.78 173.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -121.08 130.18 24.96 Favored Pre-proline 0 C--O 1.239 0.533 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 171.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.551 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 23.6 Cg_endo -61.22 162.04 21.19 Favored 'Trans proline' 0 C--N 1.371 1.758 0 C-N-CA 122.339 2.026 . . . . 0.0 112.31 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -55.02 -26.32 36.42 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 125.555 1.542 . . . . 0.0 113.153 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -77.65 -28.22 51.2 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.825 1.25 . . . . 0.0 111.989 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.6 m-20 -77.63 -21.87 51.62 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.525 0.73 . . . . 0.0 111.517 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.0 mt -73.28 117.48 15.07 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 122.886 0.474 . . . . 0.0 110.412 -176.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -94.78 -3.84 48.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.391 0.676 . . . . 0.0 110.204 172.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 16.3 p -101.01 98.0 7.91 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.618 1.167 . . . . 0.0 110.893 -176.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -76.22 -25.19 10.27 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.623 2.215 . . . . 0.0 112.191 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -59.3 -47.99 83.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.549 1.14 . . . . 0.0 110.916 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 7' ' ' LYS . 91.7 mt -70.36 -34.49 72.67 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.656 -177.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.6 mt -66.0 -51.01 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.88 -51.41 69.81 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.932 0.893 . . . . 0.0 111.025 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.93 79.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.565 0.746 . . . . 0.0 112.23 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -71.77 -54.44 10.22 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 122.722 0.409 . . . . 0.0 110.489 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.94 -37.68 79.01 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.516 0.726 . . . . 0.0 112.208 -171.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -81.55 -16.77 50.67 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.682 0.393 . . . . 0.0 111.564 -177.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.478 0.949 0 C-N-CA 122.528 0.331 . . . . 0.0 110.824 175.723 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 . . . . . 0 CA--C 1.53 0.179 0 CA-C-O 121.782 0.801 . . . . 0.0 109.187 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.6 m -104.44 153.47 21.07 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 113.885 -1.507 . . . . 0.0 108.971 -176.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.09 140.24 17.5 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 15.1 ttt85 . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.637 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 83.5 t80 . . . . . 0 N--CA 1.473 0.698 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.426 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 3.7 p -69.61 109.84 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.96 0.886 . . . . 0.0 111.193 176.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.455 HG23 HD22 ' A' ' 22' ' ' LEU . 1.7 p -76.85 140.5 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.223 171.082 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.555 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 35.1 tt0 -68.31 -59.51 3.14 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.408 0.683 . . . . 0.0 110.162 176.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -166.41 164.87 17.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.598 -176.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.426 HG21 ' HB3' ' A' ' 45' ' ' LEU . 91.6 t -83.72 137.3 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.089 0.955 . . . . 0.0 108.969 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.5 mt -110.01 -29.58 8.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.354 0.661 . . . . 0.0 110.805 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -160.31 165.33 31.5 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.691 0.396 . . . . 0.0 110.65 -173.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.2 ttt180 -139.01 134.86 33.61 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.109 1.364 . . . . 0.0 109.754 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -134.04 175.69 9.25 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.534 1.134 . . . . 0.0 109.493 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -125.23 114.67 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.594 0.758 . . . . 0.0 109.654 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 73.3 t -126.85 131.76 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 173.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 70.63 14.52 7.2 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.714 1.259 . . . . 0.0 110.924 -177.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.0 9.29 86.84 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 116.184 -0.462 . . . . 0.0 113.074 -173.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.25 155.54 23.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 56.2 t -96.4 119.98 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.72 0.808 . . . . 0.0 109.632 -171.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.655 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.6 mt-10 -119.56 138.5 53.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.417 0.687 . . . . 0.0 110.017 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -113.93 132.33 55.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.1 0.96 . . . . 0.0 110.25 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -78.12 107.82 10.97 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.455 HD22 HG23 ' A' ' 5' ' ' VAL . 39.9 mt -97.74 122.41 40.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.352 -171.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.5 tmtt? -79.89 113.69 18.24 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 161.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.7 m95 -82.75 139.02 33.84 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.119 0.568 . . . . 0.0 110.005 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.555 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 59.2 tttp -62.67 -59.2 5.23 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.563 0.745 . . . . 0.0 112.009 -166.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.29 29.07 6.28 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 113.649 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.531 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 88.7 m-85 -135.69 167.37 21.27 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.407 1.083 . . . . 0.0 109.836 174.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.4 p -82.8 171.81 13.54 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.509 0.724 . . . . 0.0 111.869 -175.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -70.26 -30.23 67.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.604 0.762 . . . . 0.0 110.98 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.85 60.64 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.546 0.738 . . . . 0.0 111.101 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -94.59 10.89 33.02 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.396 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.8 142.83 57.22 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.095 0.958 . . . . 0.0 111.662 174.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.9 p -141.33 155.61 45.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.609 0.764 . . . . 0.0 110.976 -176.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -87.29 111.26 20.87 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.787 0.835 . . . . 0.0 110.912 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -117.73 126.96 26.95 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.655 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.9 Cg_endo -67.01 157.22 62.8 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 122.497 2.131 . . . . 0.0 112.886 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -30.63 61.71 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.575 1.15 . . . . 0.0 112.885 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -67.43 -33.89 76.09 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.642 0.734 . . . . 0.0 110.346 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -89.5 -18.92 25.75 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.854 1.262 . . . . 0.0 110.833 -175.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.523 HD13 HD13 ' A' ' 46' ' ' ILE . 23.3 mt -70.51 162.73 28.26 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.784 0.434 . . . . 0.0 110.655 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -137.07 34.21 2.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 24.4 p -147.76 95.01 4.29 Favored Pre-proline 0 C--N 1.355 0.818 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.497 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.86 -16.11 18.54 Favored 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.234 1.956 . . . . 0.0 111.323 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -60.5 -43.8 96.65 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.457 1.103 . . . . 0.0 111.218 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . 0.456 HD23 ' HG3' ' B' ' 5' ' ' GLN . 69.6 mt -72.95 -44.59 60.97 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.865 0.466 . . . . 0.0 111.787 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.523 HD13 HD13 ' A' ' 40' ' ' LEU . 63.4 mt -60.94 -45.16 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 123.819 0.699 . . . . 0.0 110.536 -176.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.51 -52.99 58.85 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.339 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.32 -32.5 66.77 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.696 0.798 . . . . 0.0 112.216 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -67.29 -42.95 82.91 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.647 1.179 . . . . 0.0 110.684 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 90.2 mt -75.84 -32.34 59.74 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.162 0.585 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.42 -26.68 60.22 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.277 1.031 . . . . 0.0 110.271 -179.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 123.842 0.857 . . . . 0.0 110.293 173.345 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.456 ' HG3' HD23 ' A' ' 45' ' ' LEU . 16.5 pm0 . . . . . 0 CA--C 1.551 1.001 0 CA-C-O 121.901 0.858 . . . . 0.0 109.373 . . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 6' ' ' THR . . . . . 0.426 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 14.8 p -113.29 169.39 8.98 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.173 0.989 . . . . 0.0 111.133 -175.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.47 159.28 19.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 123.79 0.836 . . . . 0.0 109.176 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 32.8 ttm-85 . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -175.95 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 . . . . . 0 N--CA 1.47 0.566 0 CA-C-O 121.412 0.625 . . . . 0.0 109.377 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . 0.408 HG13 ' HB3' ' A' ' 25' ' ' LYS . 4.2 p -83.81 135.91 23.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.607 177.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . 0.506 HG22 ' HG ' ' A' ' 22' ' ' LEU . 1.5 p -112.99 130.7 66.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.77 -63.87 1.01 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.252 1.021 . . . . 0.0 110.171 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -165.05 169.68 16.0 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.767 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.527 HG11 ' HD2' ' A' ' 20' ' ' TYR . 99.8 t -83.08 144.64 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.815 171.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.44 -31.63 7.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.754 0.822 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -154.23 161.84 41.56 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -176.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.9 ttt180 -133.76 141.37 47.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.471 0.708 . . . . 0.0 109.223 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -148.25 171.43 15.97 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.955 0.502 . . . . 0.0 110.4 178.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -119.79 120.82 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 123.76 0.824 . . . . 0.0 109.216 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.1 t -131.62 126.49 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.21 1.004 . . . . 0.0 108.703 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.5 m120 67.23 18.06 10.31 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.938 1.295 . . . . 0.0 111.267 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.56 -18.05 48.66 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.561 -172.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -78.26 162.71 26.34 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.622 0.769 . . . . 0.0 110.128 -177.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 82.4 t -107.81 106.93 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 0.0 109.391 -175.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.593 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 89.8 mt-10 -105.14 152.86 22.29 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.327 0.651 . . . . 0.0 111.225 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.527 ' HD2' HG11 ' A' ' 8' ' ' VAL . 92.3 m-85 -132.53 136.5 46.67 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.074 1.35 . . . . 0.0 107.777 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -79.59 105.77 11.14 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 174.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.506 ' HG ' HG22 ' A' ' 5' ' ' VAL . 10.2 mp -86.88 113.53 22.75 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.398 0.679 . . . . 0.0 110.777 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtm? -72.84 97.65 2.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 168.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.557 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 83.6 m95 -65.1 123.43 19.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 174.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.408 ' HB3' HG13 ' A' ' 4' ' ' VAL . 85.0 tttt -64.95 115.49 5.43 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.398 1.061 . . . . 0.0 110.612 -172.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.08 -4.05 67.39 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 115.667 -0.697 . . . . 0.0 113.475 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.414 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 96.4 m-85 -109.7 142.25 41.15 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.964 0.905 . . . . 0.0 110.073 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 t -62.37 152.45 34.0 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.775 0.83 . . . . 0.0 111.643 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.84 -23.28 64.23 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.903 0.881 . . . . 0.0 112.747 -172.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.82 -31.16 64.6 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.902 0.481 . . . . 0.0 110.634 173.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -80.08 -30.2 39.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.706 0.802 . . . . 0.0 111.196 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.557 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -61.46 143.36 56.02 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.215 0.606 . . . . 0.0 111.195 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.9 p -126.97 169.28 13.48 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.206 0.602 . . . . 0.0 112.268 -164.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -88.25 114.66 25.09 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.743 0.817 . . . . 0.0 109.854 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.464 ' HB2' HD12 ' A' ' 22' ' ' LEU . 72.8 mm-40 -117.98 131.45 24.15 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 123.441 0.696 . . . . 0.0 109.766 173.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.593 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 67.8 Cg_endo -72.09 153.93 57.38 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 122.188 1.925 . . . . 0.0 112.18 174.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -30.68 63.37 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.192 0.997 . . . . 0.0 112.178 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.51 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 16.2 pt-20 -70.8 -8.81 55.17 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.397 1.079 . . . . 0.0 111.477 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -115.6 -7.28 12.19 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.159 0.983 . . . . 0.0 110.72 -174.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.417 HD22 HD23 ' A' ' 22' ' ' LEU . 14.1 mt -86.73 143.09 27.71 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.036 0.534 . . . . 0.0 112.04 -175.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -93.12 -6.45 47.97 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.048 0.539 . . . . 0.0 110.305 172.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . 0.524 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 21.2 p -107.15 98.47 22.4 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -175.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.9 -27.35 8.69 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.339 2.026 . . . . 0.0 111.666 173.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -61.21 -47.12 87.6 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 123.766 0.827 . . . . 0.0 111.154 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.13 -29.65 65.51 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.26 0.624 . . . . 0.0 111.762 -175.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.6 mt -66.19 -54.12 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -54.56 -53.51 53.52 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.326 1.05 . . . . 0.0 109.671 176.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -33.09 74.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.792 -168.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -65.86 -50.38 64.78 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.437 0.461 . . . . 0.0 110.246 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 72.6 mt -62.92 -32.13 73.35 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.841 0.713 . . . . 0.0 110.247 -179.608 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -71.31 -39.33 71.51 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.825 1.25 . . . . 0.0 109.463 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.471 0.614 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.299 -177.743 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . 0.524 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 2.2 mp0 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 121.47 0.652 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 35.4 p -142.67 176.31 9.14 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 124.041 0.937 . . . . 0.0 109.338 178.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -166.26 174.4 9.2 Favored 'General case' 0 C--O 1.261 1.686 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.112 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 . . . . . 0 C--O 1.237 0.399 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -178.07 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 . . . . . 0 C--O 1.239 0.518 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.7 p -74.64 125.47 34.11 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.3 p -107.19 134.92 47.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.642 -177.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' GLU . . . . . 0.4 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 8.2 tp10 -66.95 -58.15 5.52 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.543 1.137 . . . . 0.0 110.547 177.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -164.17 167.24 20.34 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.883 -170.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' VAL . . . . . 0.459 HG13 ' HB3' ' A' ' 20' ' ' TYR . 65.2 t -94.18 141.5 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 169.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.4 mt -109.44 -38.39 5.48 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.076 0.95 . . . . 0.0 111.075 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -157.85 164.39 37.0 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.921 0.489 . . . . 0.0 110.218 -172.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -130.88 138.83 49.99 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.657 1.183 . . . . 0.0 110.045 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -132.88 163.04 30.01 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.281 1.032 . . . . 0.0 109.102 174.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.0 t -130.87 109.07 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 171.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 m -118.78 125.2 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.192 0.997 . . . . 0.0 110.6 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 58.51 25.99 13.75 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.658 1.183 . . . . 0.0 112.281 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.02 -16.87 58.53 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.286 -178.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.3 ttpp -84.04 149.64 26.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.048 0.939 . . . . 0.0 109.42 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.8 t -115.98 114.44 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.82 0.848 . . . . 0.0 109.307 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' GLU . . . . . 0.654 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 40.4 mt-10 -110.43 155.23 22.49 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.154 0.502 . . . . 0.0 110.708 -179.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' TYR . . . . . 0.459 ' HB3' HG13 ' A' ' 8' ' ' VAL . 96.7 m-85 -128.36 130.23 47.42 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.246 1.018 . . . . 0.0 109.059 -177.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.67 107.39 11.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' LEU . . . . . 0.42 HD11 HD21 ' A' ' 40' ' ' LEU . 39.1 mt -95.87 129.48 43.11 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 122.843 0.457 . . . . 0.0 111.083 -171.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' LYS . . . . . 0.44 ' HG2' HD22 ' A' ' 32' ' ' ASN . 5.7 tmtm? -84.02 115.54 22.4 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 162.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' TRP . . . . . 0.527 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 82.1 m95 -79.71 130.37 35.29 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.725 0.41 . . . . 0.0 109.959 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LYS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 20.5 ttpp -67.76 -46.13 72.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.188 0.595 . . . . 0.0 111.792 -167.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.17 20.36 50.48 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.409 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.527 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 86.6 m-85 -140.0 171.27 14.43 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.761 0.824 . . . . 0.0 111.152 -176.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.1 p -80.47 172.02 14.3 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.961 0.904 . . . . 0.0 112.777 -174.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.67 -27.67 63.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.434 1.094 . . . . 0.0 111.445 176.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.05 -22.72 62.09 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.207 0.603 . . . . 0.0 110.953 175.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -85.34 -20.15 30.39 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.283 1.033 . . . . 0.0 110.927 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' ASN . . . . . 0.44 HD22 ' HG2' ' A' ' 23' ' ' LYS . 11.0 m-20 -48.87 121.69 4.95 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.364 1.066 . . . . 0.0 111.643 176.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.46 158.13 45.16 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.268 0.627 . . . . 0.0 112.003 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -81.4 113.09 19.25 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.568 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' GLU . . . . . 0.422 ' HB2' HD22 ' A' ' 40' ' ' LEU . 46.3 mm-40 -117.43 129.07 25.59 Favored Pre-proline 0 CA--C 1.544 0.714 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' PRO . . . . . 0.654 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.6 Cg_endo -66.57 159.0 52.86 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 122.526 2.151 . . . . 0.0 113.287 177.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' GLU . . . . . 0.426 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -63.19 -28.31 69.96 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.654 0.781 . . . . 0.0 112.323 -177.532 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' GLU . . . . . 0.517 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.0 pt-20 -68.36 -20.68 64.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.156 0.982 . . . . 0.0 111.27 175.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -103.91 -7.17 20.64 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.618 1.167 . . . . 0.0 110.293 -175.056 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 35' ' ' GLU . 18.5 mt -89.51 137.31 32.44 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.206 0.602 . . . . 0.0 110.838 178.433 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -100.07 -3.01 32.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.39 0.676 . . . . 0.0 109.438 170.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.7 p -106.57 91.75 6.35 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.141 0.976 . . . . 0.0 110.618 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.31 -14.28 4.89 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.423 2.082 . . . . 0.0 112.501 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -70.44 -44.11 68.5 Favored 'General case' 0 C--O 1.215 -0.744 0 C-N-CA 123.825 0.85 . . . . 0.0 109.843 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.21 -33.59 76.37 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.509 0.724 . . . . 0.0 111.01 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ILE . . . . . 0.52 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 75.2 mt -64.41 -55.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 174.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.26 -45.49 80.06 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.091 0.956 . . . . 0.0 111.326 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.11 -42.39 99.17 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.237 1.015 . . . . 0.0 110.802 -177.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -60.31 -50.48 73.46 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.694 174.577 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 81.5 mt -62.06 -36.49 81.8 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.802 0.841 . . . . 0.0 111.255 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.32 -40.09 62.44 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 110.39 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.0 m . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 123.342 0.657 . . . . 0.0 112.563 -178.533 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 . . . . . 0 C--O 1.243 0.755 0 CA-C-O 121.934 0.873 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 36.3 p -126.28 177.56 6.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.321 -1.308 . . . . 0.0 109.861 -177.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.93 171.83 16.17 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.134 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 . . . . . 0 C--N 1.319 -0.75 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 -174.015 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.442 0 N-CA-C 112.218 -0.353 . . . . 0.0 112.218 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -100.67 108.74 20.68 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 174.207 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -106.62 147.66 29.24 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.346 0.658 . . . . 0.0 110.24 -172.593 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.3 p -78.5 119.67 27.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.7 0 C-N-CA 123.153 0.581 . . . . 0.0 110.354 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.469 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.5 p -93.24 137.55 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.566 172.075 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.15 -51.5 8.9 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.614 0.766 . . . . 0.0 110.829 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -161.25 169.45 22.16 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.671 0.607 . . . . 0.0 111.511 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 58.6 t -100.19 143.12 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.286 172.473 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.401 HD12 ' ND2' ' A' ' 32' ' ' ASN . 72.4 mt -108.52 -39.2 5.47 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.218 1.007 . . . . 0.0 111.429 178.574 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -154.02 166.4 33.13 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 122.755 0.422 . . . . 0.0 110.957 -174.2 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.532 HH11 HD23 ' A' ' 50' ' ' LEU . 53.5 ttt180 -142.2 148.73 38.67 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.738 1.215 . . . . 0.0 110.36 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -152.36 174.56 13.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.723 1.209 . . . . 0.0 109.25 173.958 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.566 HG22 HG21 ' A' ' 18' ' ' VAL . 94.6 t -123.11 116.03 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.667 0.787 . . . . 0.0 109.796 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -118.56 121.24 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.074 0.949 . . . . 0.0 109.369 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 64.05 23.6 13.29 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.86 1.264 . . . . 0.0 112.252 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.51 -23.35 32.64 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.444 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.89 157.33 24.39 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.942 0.897 . . . . 0.0 109.116 176.328 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.566 HG21 HG22 ' A' ' 13' ' ' VAL . 99.4 t -113.08 114.29 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.476 0.71 . . . . 0.0 109.438 -173.981 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.561 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -109.39 134.37 51.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.631 0.773 . . . . 0.0 110.562 -177.801 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 48.8 m-85 -108.77 128.46 54.9 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.055 0.942 . . . . 0.0 109.774 -179.592 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.92 108.37 9.92 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.615 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.422 ' O ' ' HB2' ' A' ' 32' ' ' ASN . 57.8 mt -82.8 -174.71 5.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.547 0.689 . . . . 0.0 112.236 -171.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -144.71 112.91 6.47 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 103.947 -2.612 . . . . 0.0 103.947 163.96 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.469 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 87.5 m95 -79.03 147.75 32.73 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.012 0.434 . . . . 0.0 111.411 -173.834 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.442 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -85.1 -36.21 21.3 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.506 172.525 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -73.19 -28.98 65.17 Favored Glycine 0 C--N 1.357 1.696 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.317 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -120.43 171.91 8.19 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.769 0.828 . . . . 0.0 110.956 -174.737 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.6 p -70.65 161.78 30.14 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 123.182 0.593 . . . . 0.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.72 -27.09 65.63 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.4 0.68 . . . . 0.0 112.109 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.46 -19.02 34.05 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.449 0.7 . . . . 0.0 111.263 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.53 1.62 41.05 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.37 0.668 . . . . 0.0 110.886 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.465 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 31.1 p-10 -56.96 146.98 25.1 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 124.368 1.067 . . . . 0.0 112.718 175.587 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.428 HG21 HM33 ' B' ' 9' ' ' M3L . 7.2 p -140.9 158.71 43.57 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.4 -173.294 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -76.95 115.95 17.19 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.111 0.965 . . . . 0.0 110.31 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -124.56 131.3 24.14 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.561 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 63.8 Cg_endo -70.85 154.61 63.33 Favored 'Trans proline' 0 C--N 1.365 1.395 0 C-N-CA 122.439 2.092 . . . . 0.0 112.438 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -28.34 56.45 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.469 1.107 . . . . 0.0 112.289 178.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.532 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.3 pt-20 -66.27 -31.92 73.02 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 123.664 0.603 . . . . 0.0 111.279 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.402 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 3.1 m-20 -93.9 -18.47 21.93 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.942 0.897 . . . . 0.0 111.593 177.925 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.434 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 61.1 mt -76.75 124.86 28.31 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 176.936 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -103.48 23.82 12.0 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 171.258 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.473 ' HB3' ' HB3' ' B' ' 5' ' ' GLN . 21.3 p -112.52 89.67 13.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 123.942 0.897 . . . . 0.0 110.505 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -73.63 -33.02 7.08 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.888 2.392 . . . . 0.0 111.814 173.635 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.96 -50.21 73.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.559 -1.201 . . . . 0.0 111.418 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.426 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 77.8 mt -70.22 -36.84 74.83 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.599 -175.708 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.2 -49.7 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.803 0.441 . . . . 0.0 110.405 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.97 -50.63 72.72 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.573 0.546 . . . . 0.0 110.626 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.62 -38.76 85.81 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 124.056 0.848 . . . . 0.0 111.457 -176.992 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -64.06 -42.92 96.85 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.733 0.813 . . . . 0.0 111.508 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.532 HD23 HH11 ' A' ' 11' ' ' ARG . 84.2 mt -68.52 -35.46 77.5 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.092 0.557 . . . . 0.0 110.396 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -66.4 -31.34 72.04 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.136 0.974 . . . . 0.0 110.948 175.072 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -69.72 -38.86 77.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.377 0.671 . . . . 0.0 110.833 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -71.98 -27.69 62.92 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.386 0.674 . . . . 0.0 111.543 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.568 -0.73 . . . . 0.0 109.335 -178.834 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 120.502 0.191 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 mmt180 -97.31 104.22 16.22 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.418 0.687 . . . . 0.0 110.3 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 52.3 p -85.53 86.82 7.35 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.31 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -100.04 131.21 46.14 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.999 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.473 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.7 mm-40 -123.42 137.83 54.72 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.254 1.022 . . . . 0.0 108.662 174.351 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 28.2 p -97.71 147.38 24.42 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.391 0.676 . . . . 0.0 111.215 -175.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.12 144.02 24.53 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.145 0.978 . . . . 0.0 109.845 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.402 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 16.1 mtp180 -106.74 130.66 54.42 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.182 0.993 . . . . 0.0 108.69 -178.115 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.428 HM33 HG21 ' A' ' 33' ' ' THR . . . . . . . . 0 N--CA 1.469 0.491 0 CA-C-O 121.054 0.454 . . . . 0.0 110.761 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 27.0 t -72.05 84.81 1.0 Allowed 'General case' 0 C--O 1.242 0.704 0 C-N-CA 124.751 1.22 . . . . 0.0 110.165 178.965 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 30.6 p -78.77 86.5 4.7 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.696 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.78 -157.35 18.69 Favored Glycine 0 C--N 1.342 0.914 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.44 -171.176 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -172.04 112.86 0.46 Allowed Glycine 0 C--N 1.344 1.02 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.588 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.507 ' HE3' ' HA ' ' B' ' 14' ' ' LYS . 0.8 OUTLIER -73.81 89.0 1.81 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 122.967 0.507 . . . . 0.0 110.503 -176.132 . . . . . . . . 3 3 . 1 . 001 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.911 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.206 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.222 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.473 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 4.9 mp0 -91.14 147.05 23.33 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 123.905 0.882 . . . . 0.0 108.963 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -145.98 155.53 42.89 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.444 0.698 . . . . 0.0 109.394 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.42 109.71 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.544 0.738 . . . . 0.0 111.887 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.525 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.7 p -85.11 137.48 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 165.141 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -76.74 -54.64 6.36 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.199 0.6 . . . . 0.0 110.311 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.406 ' HA ' HD13 ' A' ' 45' ' ' LEU . 19.3 ptmt -160.28 164.94 32.23 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.001 0.52 . . . . 0.0 111.97 177.76 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.4 HG12 ' HD2' ' A' ' 20' ' ' TYR . 89.6 t -86.73 134.58 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.356 1.062 . . . . 0.0 109.614 171.977 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.2 mt -101.6 -39.15 7.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.507 0.723 . . . . 0.0 110.887 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -149.41 165.37 32.27 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.518 0.327 . . . . 0.0 110.696 -172.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -132.97 144.03 49.85 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.277 1.031 . . . . 0.0 109.154 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.34 172.44 15.38 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.778 0.831 . . . . 0.0 109.684 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.504 HG22 HG21 ' A' ' 18' ' ' VAL . 76.5 t -127.5 121.95 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.302 1.041 . . . . 0.0 108.976 175.2 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.459 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 69.2 t -129.38 125.79 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 63.96 20.0 12.01 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.412 1.085 . . . . 0.0 112.332 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.79 -12.86 62.63 Favored Glycine 0 C--N 1.348 1.244 0 CA-C-O 119.949 -0.362 . . . . 0.0 113.974 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.459 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptpt -98.4 165.32 11.9 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.404 0.602 . . . . 0.0 109.459 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.504 HG21 HG22 ' A' ' 13' ' ' VAL . 56.5 t -107.96 119.37 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.12 0.568 . . . . 0.0 109.685 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.529 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.7 mt-10 -110.16 139.0 45.77 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.406 0.682 . . . . 0.0 110.211 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.4 ' HD2' HG12 ' A' ' 8' ' ' VAL . 61.7 m-85 -111.57 140.68 45.98 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.659 0.784 . . . . 0.0 110.11 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -79.08 108.04 12.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.464 HD21 HG23 ' A' ' 5' ' ' VAL . 23.2 mt -95.37 120.47 35.67 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.115 0.566 . . . . 0.0 110.757 -174.883 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.734 ' HD3' ' HA ' ' A' ' 29' ' ' ASP . 0.0 OUTLIER -91.62 113.03 25.19 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 166.33 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.525 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 68.9 m95 -79.06 150.12 31.94 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.817 0.847 . . . . 0.0 111.03 -173.541 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -88.79 -39.37 13.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.944 0.498 . . . . 0.0 111.156 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.67 -33.37 60.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.217 177.804 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -94.03 162.44 13.88 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.398 0.679 . . . . 0.0 110.289 174.089 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.1 p -72.36 172.11 10.97 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.507 0.723 . . . . 0.0 111.631 -177.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.734 ' HA ' ' HD3' ' A' ' 23' ' ' LYS . 1.2 m-20 -69.44 -17.59 63.65 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.281 0.632 . . . . 0.0 110.919 173.341 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.75 -19.09 60.37 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.778 0.831 . . . . 0.0 111.7 173.787 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -121.78 85.36 2.4 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.634 0.731 . . . . 0.0 109.466 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.405 ' HB3' ' HA ' ' A' ' 23' ' ' LYS . 6.9 p30 -125.61 136.48 53.31 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.749 1.22 . . . . 0.0 110.179 173.674 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.2 p -130.85 154.79 47.68 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.656 0.783 . . . . 0.0 111.114 -173.375 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -80.84 123.68 28.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.967 0.907 . . . . 0.0 110.313 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -123.79 138.94 31.29 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 123.186 0.594 . . . . 0.0 109.563 171.482 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.529 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 60.9 Cg_endo -68.83 158.94 55.84 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 122.726 2.284 . . . . 0.0 112.302 175.878 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.452 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 11.3 pt-20 -65.74 -26.05 67.56 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.106 0.562 . . . . 0.0 111.615 -175.816 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.473 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.9 pt-20 -62.07 -32.19 72.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.959 0.904 . . . . 0.0 110.971 175.227 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.427 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 7.9 m-20 -80.09 -32.32 39.2 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.85 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.452 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 13.4 mt -72.27 131.97 43.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.055 -176.983 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -123.97 66.38 1.04 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.659 ' SG ' ' HG2' ' B' ' 5' ' ' GLN . 36.2 t -152.6 112.07 2.77 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 114.38 -1.282 . . . . 0.0 110.353 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -78.71 -23.54 8.14 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.125 1.883 . . . . 0.0 111.885 168.314 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -63.32 -58.7 6.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.987 0.915 . . . . 0.0 111.872 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.454 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 87.5 mt -72.18 -39.16 68.85 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.642 0.777 . . . . 0.0 112.285 -169.947 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.7 mt -65.41 -51.2 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 123.692 0.62 . . . . 0.0 110.406 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -66.0 -40.66 91.34 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.076 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.29 -37.06 86.01 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.832 0.453 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.13 -46.27 91.26 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.783 0.833 . . . . 0.0 110.534 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.439 ' HA ' ' NE2' ' A' ' 53' ' ' GLN . 82.2 mt -68.48 -37.22 79.95 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.145 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -82.61 -14.86 54.05 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.635 0.774 . . . . 0.0 112.077 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 t -81.26 -24.05 37.58 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.171 0.588 . . . . 0.0 109.901 174.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.439 ' NE2' ' HA ' ' A' ' 50' ' ' LEU . 48.7 mt-30 -70.37 -29.1 65.68 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.896 171.205 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt . . . . . 0 CA--C 1.551 0.992 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.994 176.28 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.276 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -103.4 7.47 38.08 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.667 0.787 . . . . 0.0 111.762 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 3' ' ' THR . . . . . 0.592 ' HB ' HE22 ' B' ' 5' ' ' GLN . 12.7 p -88.57 117.28 27.41 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.613 0.765 . . . . 0.0 112.042 -173.189 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -105.6 105.49 15.55 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.246 0.618 . . . . 0.0 109.403 176.695 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.659 ' HG2' ' SG ' ' A' ' 42' ' ' CYS . 2.0 mp0 -127.75 127.7 44.06 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.894 0.478 . . . . 0.0 109.887 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 54.1 m -72.06 117.78 14.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.449 1.1 . . . . 0.0 109.707 177.372 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.67 110.81 7.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.05 0.54 . . . . 0.0 109.918 176.796 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.473 ' HA ' ' HA ' ' A' ' 2' ' ' GLU . 39.6 ttt180 -65.82 144.37 56.89 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.548 1.139 . . . . 0.0 111.085 177.503 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.237 0.416 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.993 169.341 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 29.6 t -75.97 81.42 2.84 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.174 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 76.7 p -80.91 -22.83 39.4 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.021 -177.456 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -130.44 75.1 0.43 Allowed Glycine 0 C--N 1.349 1.251 0 N-CA-C 111.904 -0.478 . . . . 0.0 111.904 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.06 78.9 1.2 Allowed Glycine 0 C--N 1.347 1.186 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 172.588 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -153.1 169.84 21.96 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.613 0.765 . . . . 0.0 111.133 -170.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.209 0 C-N-CA 124.238 1.015 . . . . 0.0 108.484 176.433 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.51 ' HA2' ' HG2' ' B' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.48 1.588 0 N-CA-C 112.683 -0.167 . . . . 0.0 112.683 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -153.85 -32.47 0.11 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.083 0.953 . . . . 0.0 109.869 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -69.99 151.81 45.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.299 0.639 . . . . 0.0 110.378 -177.202 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.467 HG11 ' O ' ' A' ' 25' ' ' LYS . 3.0 p -113.23 125.18 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 123.124 0.57 . . . . 0.0 110.658 -174.554 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.563 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.1 p -114.88 140.04 38.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 124.677 1.191 . . . . 0.0 110.405 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -73.24 -57.34 4.09 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.365 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.417 ' HA ' HD21 ' A' ' 45' ' ' LEU . 21.2 ptmt -164.2 162.57 22.76 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.307 0.575 . . . . 0.0 112.368 -174.722 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.493 HG21 ' HB3' ' A' ' 45' ' ' LEU . 93.3 t -84.3 143.7 11.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-N 114.649 -1.159 . . . . 0.0 108.857 169.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.54 -42.57 4.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.236 0.614 . . . . 0.0 110.577 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -151.77 164.86 36.1 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.84 0.456 . . . . 0.0 110.538 -171.871 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 77.3 ttt180 -124.18 159.54 29.87 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.415 1.086 . . . . 0.0 110.206 -174.941 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -159.43 167.09 29.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.634 0.774 . . . . 0.0 109.329 173.417 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -121.89 121.11 63.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.51 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 89.9 t -125.3 114.85 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.239 1.016 . . . . 0.0 109.041 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 65.78 12.06 8.05 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.329 1.051 . . . . 0.0 112.275 174.474 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 110.56 -25.04 16.06 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 123.315 0.484 . . . . 0.0 113.37 -174.698 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.51 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.8 ptpt -81.52 174.26 11.6 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 85.1 t -120.79 123.77 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.592 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 39.9 mt-10 -105.51 138.33 41.88 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.228 0.537 . . . . 0.0 110.341 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -111.84 136.66 50.83 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.548 1.139 . . . . 0.0 109.171 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -80.21 105.56 11.57 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.419 HD23 HG23 ' A' ' 5' ' ' VAL . 23.5 mt -91.62 112.63 24.63 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.512 -175.973 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -85.0 105.83 16.05 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 165.727 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.563 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 80.3 m95 -73.84 154.01 39.66 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.439 0.695 . . . . 0.0 112.039 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.467 ' O ' HG11 ' A' ' 4' ' ' VAL . 25.4 ttpp -112.14 151.41 29.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.1 -48.32 4.01 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -174.627 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -66.96 165.62 15.21 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.201 1.0 . . . . 0.0 109.584 165.248 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -65.75 152.43 44.32 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-O 120.812 0.339 . . . . 0.0 110.988 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.45 -31.56 70.95 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.764 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.38 -17.46 56.43 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.192 0.597 . . . . 0.0 111.597 176.495 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -84.59 65.32 8.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.856 0.862 . . . . 0.0 109.486 -178.718 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.551 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 16.2 p30 -111.03 149.08 31.24 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.006 1.322 . . . . 0.0 110.57 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 52.5 p -139.36 164.52 29.62 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.938 0.895 . . . . 0.0 110.476 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -86.15 123.78 31.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.72 133.69 24.99 Favored Pre-proline 0 N--CA 1.472 0.634 0 C-N-CA 122.818 0.447 . . . . 0.0 110.576 172.678 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.592 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 43.7 Cg_endo -65.77 160.61 42.88 Favored 'Trans proline' 0 C--N 1.366 1.485 0 C-N-CA 122.572 2.181 . . . . 0.0 112.384 176.691 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -25.47 65.58 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.62 1.168 . . . . 0.0 112.021 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.418 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 13.0 pt-20 -68.68 -23.02 64.34 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.406 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -89.98 -22.58 21.85 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.689 1.195 . . . . 0.0 111.488 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.403 ' CD2' HD11 ' A' ' 22' ' ' LEU . 21.1 mt -77.79 117.0 18.74 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.901 0.48 . . . . 0.0 111.426 -172.024 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.29 -27.56 27.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.506 ' SG ' ' HG ' ' A' ' 45' ' ' LEU . 51.1 t -80.62 109.38 12.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 123.891 0.876 . . . . 0.0 110.714 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -79.07 -17.86 11.66 Favored 'Trans proline' 0 C--N 1.377 2.037 0 C-N-CA 122.274 1.983 . . . . 0.0 111.476 173.551 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.431 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 12.7 tp10 -65.52 -52.44 52.59 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 124.644 1.178 . . . . 0.0 110.917 -176.693 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.506 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 75.3 mt -64.9 -29.23 70.16 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.196 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.505 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 31.7 mt -70.63 -55.84 12.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.23 -55.83 21.65 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.474 -170.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.74 79.28 Favored 'General case' 0 N--CA 1.481 1.109 0 O-C-N 124.082 0.863 . . . . 0.0 111.611 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.0 t80 -63.98 -39.03 93.2 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.463 1.105 . . . . 0.0 111.727 177.239 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.505 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 89.7 mt -67.76 -38.11 83.01 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.535 0.334 . . . . 0.0 110.281 178.394 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.04 -28.33 65.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.664 . . . . 0.0 111.195 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m -64.87 -24.32 67.5 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.243 0.617 . . . . 0.0 111.451 176.737 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -104.61 -4.49 22.48 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.076 0.95 . . . . 0.0 111.081 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt . . . . . 0 C--O 1.25 1.089 0 C-N-CA 123.95 0.9 . . . . 0.0 109.032 -175.255 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 121.145 0.497 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -120.0 129.74 54.41 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.958 0.903 . . . . 0.0 110.355 -176.158 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 8.7 t -95.29 135.31 37.05 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.806 0.843 . . . . 0.0 111.032 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -93.33 71.56 4.45 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.526 0.679 . . . . 0.0 110.028 176.1 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.421 HE22 HD22 ' A' ' 45' ' ' LEU . 13.0 mt-30 -71.38 135.11 47.14 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.891 175.417 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 19.2 m -111.02 150.14 29.73 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 121.49 0.662 . . . . 0.0 111.151 -165.652 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.49 18.39 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 124.934 1.293 . . . . 0.0 109.381 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.51 ' HG2' ' HA2' ' A' ' 1' ' ' GLY . 0.0 OUTLIER -119.29 146.02 45.62 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.38 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.467 ' N ' ' HD3' ' B' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.471 0.614 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 169.899 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 32.4 t -62.49 122.67 16.33 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 123.84 0.712 . . . . 0.0 109.286 -179.246 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 39.8 p -60.04 -20.27 57.08 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 124.335 1.054 . . . . 0.0 112.736 -176.354 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.35 -121.94 0.85 Allowed Glycine 0 C--N 1.342 0.894 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 173.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -152.13 150.6 22.48 Favored Glycine 0 C--N 1.336 0.557 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . 0.551 ' HB2' ' HZ1' ' B' ' 14' ' ' LYS . 4.9 ttmp? -145.51 129.68 17.59 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.754 0.822 . . . . 0.0 109.183 -177.611 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.141 0 C-N-CA 124.121 0.968 . . . . 0.0 109.457 -176.485 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.433 0 N-CA-C 113.281 0.073 . . . . 0.0 113.281 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -96.23 -55.1 3.06 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.968 0.507 . . . . 0.0 110.55 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -130.86 146.24 52.24 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.515 0.726 . . . . 0.0 110.0 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.465 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 11.1 m -66.75 134.0 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.019 176.768 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.444 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -101.97 131.65 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.568 0.747 . . . . 0.0 109.351 173.715 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.37 -56.28 7.05 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.379 0.671 . . . . 0.0 110.585 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.432 ' HA ' HD22 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -159.3 163.07 36.05 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.121 0.486 . . . . 0.0 111.673 -177.234 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.412 HG21 ' HB3' ' A' ' 45' ' ' LEU . 72.2 t -82.04 129.19 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.586 171.603 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.3 mt -86.67 -54.5 4.35 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.199 1.0 . . . . 0.0 110.176 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -151.9 164.51 36.95 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.27 -172.96 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -131.17 141.22 50.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.392 1.077 . . . . 0.0 109.297 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -136.45 171.05 15.06 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.786 0.834 . . . . 0.0 109.561 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.414 ' HA ' ' O ' ' A' ' 17' ' ' LYS . 90.4 t -124.1 115.2 44.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 124.205 1.002 . . . . 0.0 108.95 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.418 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 92.4 t -126.31 127.97 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.161 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.7 t30 66.08 15.86 10.24 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.2 1.0 . . . . 0.0 111.031 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.54 14.57 75.74 Favored Glycine 0 C--N 1.35 1.33 0 CA-C-N 116.03 -0.532 . . . . 0.0 113.651 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.418 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 14.5 ptmt -108.92 157.25 18.8 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.4 t -96.67 125.24 49.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.554 0.741 . . . . 0.0 109.742 177.464 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.472 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 47.1 mt-10 -120.93 135.98 55.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.389 0.676 . . . . 0.0 109.997 174.336 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.411 ' HE2' ' HB3' ' A' ' 37' ' ' GLU . 96.3 m-85 -109.79 129.47 55.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.447 1.099 . . . . 0.0 109.893 177.693 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.23 107.95 8.82 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 174.985 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 18.3 mt -102.66 127.44 49.77 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 122.876 0.47 . . . . 0.0 111.347 -172.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? -96.01 121.28 37.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.58 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.444 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 66.4 m95 -82.2 137.77 34.84 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.147 0.579 . . . . 0.0 111.27 -173.025 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 37.7 ttpt -76.6 132.28 39.36 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 123.665 0.786 . . . . 0.0 110.576 -173.872 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.78 -0.24 89.58 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.689 0.618 . . . . 0.0 113.834 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -104.86 173.36 6.33 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.324 1.05 . . . . 0.0 110.966 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.1 p -65.44 162.05 18.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.791 0.836 . . . . 0.0 112.015 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.81 -41.6 99.36 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.532 0.733 . . . . 0.0 111.248 -176.894 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.63 -16.59 63.41 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.256 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -81.24 77.73 8.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.139 0.976 . . . . 0.0 109.168 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -143.02 131.51 22.33 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 113.987 -1.461 . . . . 0.0 109.794 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 p -131.74 147.42 52.5 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.957 0.903 . . . . 0.0 110.465 -173.809 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -76.49 109.53 10.3 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.88 0.472 . . . . 0.0 110.041 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -114.12 129.69 24.59 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.403 1.081 . . . . 0.0 110.458 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.472 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 72.7 Cg_endo -72.29 150.81 53.56 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.442 2.095 . . . . 0.0 111.985 175.799 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.499 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.06 -26.69 64.84 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.319 1.048 . . . . 0.0 113.09 -176.671 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.85 -31.56 72.58 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.658 0.783 . . . . 0.0 111.215 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -91.44 -14.23 30.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.033 0.933 . . . . 0.0 110.555 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.499 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 10.0 mt -79.07 141.01 37.74 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.786 0.434 . . . . 0.0 110.096 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -97.06 0.2 48.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.247 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.505 ' HA ' ' HG2' ' B' ' 5' ' ' GLN . 33.5 t -111.02 96.98 32.55 Favored Pre-proline 0 C--N 1.356 0.848 0 C-N-CA 123.661 0.785 . . . . 0.0 111.453 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -78.85 -17.15 12.41 Favored 'Trans proline' 0 C--N 1.375 1.953 0 C-N-CA 122.665 2.243 . . . . 0.0 111.578 169.956 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -71.13 -43.94 66.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.024 0.929 . . . . 0.0 110.737 -176.606 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.432 HD22 ' HA ' ' A' ' 7' ' ' LYS . 21.2 mt -68.35 -40.18 81.61 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.124 0.569 . . . . 0.0 111.55 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.523 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 66.6 mt -58.62 -52.15 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 123.814 0.696 . . . . 0.0 109.781 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.9 -52.66 64.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.568 0.747 . . . . 0.0 111.298 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.32 71.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.856 0.862 . . . . 0.0 111.598 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.7 -45.3 71.96 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.129 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.523 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 79.9 mt -64.85 -35.97 82.85 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 110.403 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.04 -29.09 61.73 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.101 0.96 . . . . 0.0 110.299 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 24.8 t -75.61 -18.74 59.61 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.43 0.692 . . . . 0.0 110.626 177.306 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -73.38 -33.34 64.98 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.081 0.552 . . . . 0.0 110.055 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt . . . . . 0 C--O 1.252 1.234 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.321 -179.364 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -74.38 -22.64 59.09 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.981 168.4 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 81.6 p -75.55 145.76 41.0 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 124.16 0.984 . . . . 0.0 111.841 -172.187 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -121.85 -6.45 9.05 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.903 176.393 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.505 ' HG2' ' HA ' ' A' ' 42' ' ' CYS . 4.6 tp-100 -75.8 154.93 35.9 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.231 0.613 . . . . 0.0 111.457 -166.869 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.465 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 2.0 m -107.02 171.88 7.13 Favored 'General case' 0 CA--C 1.561 1.374 0 C-N-CA 124.021 0.928 . . . . 0.0 110.729 -166.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.8 144.46 17.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.751 0.82 . . . . 0.0 109.423 171.473 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -88.66 144.38 26.33 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.977 0.511 . . . . 0.0 109.995 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.695 0 C-N-CA 123.465 0.706 . . . . 0.0 109.932 176.639 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 49.5 m -74.36 87.25 2.02 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.23 0.612 . . . . 0.0 109.42 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 37.0 m -123.91 104.75 9.11 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.772 0.829 . . . . 0.0 109.362 -178.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.68 -49.5 0.06 OUTLIER Glycine 0 C--N 1.343 0.961 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 68.54 -91.07 0.25 Allowed Glycine 0 C--N 1.349 1.268 0 O-C-N 124.128 0.546 . . . . 0.0 112.582 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.39 156.17 26.8 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.45 0.7 . . . . 0.0 110.478 175.068 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.194 0 C-N-CA 124.202 1.001 . . . . 0.0 108.665 175.544 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 112.813 -0.115 . . . . 0.0 112.813 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -101.06 -31.75 10.93 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.116 0.566 . . . . 0.0 111.614 -174.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -129.88 137.94 50.68 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.247 0.619 . . . . 0.0 110.216 -173.988 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -80.66 110.81 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.825 0.821 . . . . 0.0 110.388 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.412 HG21 HD23 ' A' ' 22' ' ' LEU . 1.4 p -81.6 131.39 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.733 168.353 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.505 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 39.1 tt0 -74.94 -49.49 19.97 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 174.427 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.562 ' HZ1' ' HB2' ' A' ' 7' ' ' LYS . 0.0 OUTLIER -161.89 162.42 29.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.318 0.58 . . . . 0.0 111.015 -172.825 . . . . . . . . 3 3 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.443 HG13 ' HD2' ' A' ' 20' ' ' TYR . 61.1 t -89.99 141.27 14.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.363 172.145 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.3 mt -105.42 -47.6 3.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.96 0.904 . . . . 0.0 109.918 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -144.62 164.47 30.85 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 55.6 ttt180 -138.75 126.5 22.16 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.324 1.05 . . . . 0.0 109.509 -175.595 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -126.83 164.17 21.98 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.761 0.824 . . . . 0.0 109.856 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.8 t -125.61 116.79 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.2 t -123.62 118.9 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.088 0.955 . . . . 0.0 109.559 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 62.34 32.6 16.88 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.811 1.245 . . . . 0.0 111.784 175.493 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.2 -26.81 11.8 Favored Glycine 0 N--CA 1.472 1.046 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.301 -177.478 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -79.44 152.74 30.14 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 123.995 0.918 . . . . 0.0 109.48 -177.811 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.9 t -114.34 113.69 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.578 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 49.7 mt-10 -106.49 153.47 22.25 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.971 0.908 . . . . 0.0 110.536 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.443 ' HD2' HG13 ' A' ' 8' ' ' VAL . 92.6 m-85 -132.01 126.88 35.02 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.296 1.038 . . . . 0.0 108.95 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -77.55 107.47 10.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.412 HD23 HG21 ' A' ' 5' ' ' VAL . 42.3 mt -96.71 123.34 40.37 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.112 0.565 . . . . 0.0 111.734 -168.987 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -73.83 106.05 5.38 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 165.474 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.473 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 76.4 m95 -78.93 116.92 19.55 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 173.851 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . 38.7 ttpt -61.9 -41.05 97.43 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.756 0.823 . . . . 0.0 112.338 -170.449 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.62 5.83 79.99 Favored Glycine 0 CA--C 1.534 1.274 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -132.09 170.73 14.56 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.691 0.796 . . . . 0.0 111.407 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 77.5 p -72.83 160.99 31.29 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.533 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.9 -29.56 63.24 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.342 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -22.43 63.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.991 0.516 . . . . 0.0 111.351 174.926 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -92.29 -1.13 57.28 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.541 0.737 . . . . 0.0 111.164 -178.506 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.473 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 84.4 m-20 -64.89 139.49 58.77 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.978 0.511 . . . . 0.0 110.666 173.372 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 39.5 p -131.57 155.77 46.92 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.185 0.594 . . . . 0.0 112.116 -170.894 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -77.3 113.48 15.12 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.532 0.733 . . . . 0.0 109.444 171.978 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -121.9 129.56 25.1 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 122.913 0.485 . . . . 0.0 110.379 176.647 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.578 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 73.4 Cg_endo -71.75 149.89 55.23 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 122.737 2.291 . . . . 0.0 112.18 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.433 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 9.5 pt-20 -60.28 -24.0 64.58 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.867 0.867 . . . . 0.0 112.741 -175.405 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.495 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 9.3 pt-20 -65.81 -35.36 80.48 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.902 0.881 . . . . 0.0 111.307 175.773 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -82.42 -21.94 35.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.386 1.074 . . . . 0.0 110.687 -175.191 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.491 HD23 ' HB1' ' B' ' 7' ' ' ALA . 7.6 mt -86.14 142.14 28.87 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -108.75 26.13 10.93 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 173.382 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 47.0 t -117.28 90.85 35.4 Favored Pre-proline 0 C--N 1.346 0.451 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.902 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -70.96 -22.16 26.93 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 122.507 2.138 . . . . 0.0 111.013 170.202 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.86 -60.18 3.95 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 124.118 0.967 . . . . 0.0 111.445 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.441 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 89.6 mt -78.22 -29.73 48.45 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.802 0.441 . . . . 0.0 112.027 -172.031 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.462 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 93.0 mt -63.68 -56.08 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -41.56 69.66 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.594 -174.385 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -34.23 77.68 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.046 0.216 . . . . 0.0 111.148 -177.871 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -60.42 -44.21 95.98 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.606 0.762 . . . . 0.0 110.799 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.462 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 69.4 mt -66.92 -39.02 87.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.781 178.019 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -71.61 -21.77 61.8 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.904 0.882 . . . . 0.0 111.42 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.1 m -72.23 -31.19 65.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.064 0.545 . . . . 0.0 110.226 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -77.01 -32.77 57.38 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.332 0.653 . . . . 0.0 110.559 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.49 ' HZ2' ' HB3' ' A' ' 54' ' ' LYS . 1.6 mmmp? . . . . . 0 C--O 1.25 1.088 0 C-N-CA 123.622 0.769 . . . . 0.0 109.475 -176.32 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -84.59 -1.72 56.38 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.74 0.816 . . . . 0.0 111.028 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 13.6 p -65.16 97.32 0.25 Allowed 'General case' 0 C--O 1.244 0.796 0 C-N-CA 123.596 0.758 . . . . 0.0 110.994 174.359 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.431 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 26.6 mtpp -68.86 145.91 53.3 Favored 'General case' 0 C--O 1.244 0.764 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 168.392 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.479 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 20.5 tp60 -56.84 123.02 13.59 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 123.717 0.635 . . . . 0.0 110.029 -172.491 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -86.75 173.98 9.12 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 124.106 0.963 . . . . 0.0 113.075 -160.419 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . 0.491 ' HB1' HD23 ' A' ' 40' ' ' LEU . . . -147.78 155.06 41.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -97.11 164.93 12.3 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.751 0 CA-C-O 121.301 0.572 . . . . 0.0 109.837 168.831 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 13.3 p -75.9 95.11 3.46 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.116 -177.48 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.1 t -142.24 136.4 29.82 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 124.181 0.993 . . . . 0.0 108.941 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.13 -64.52 0.03 OUTLIER Glycine 0 C--N 1.34 0.784 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 169.7 120.21 0.52 Allowed Glycine 0 C--N 1.346 1.107 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -99.99 135.85 40.79 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.682 0.793 . . . . 0.0 109.811 176.233 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.34 0 C-N-CA 123.015 0.526 . . . . 0.0 109.764 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.408 ' HA3' ' HB2' ' B' ' 9' ' ' M3L . . . . . . . . 0 N--CA 1.486 2.008 0 N-CA-C 111.799 -0.52 . . . . 0.0 111.799 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.691 ' HG3' ' HG2' ' B' ' 8' ' ' ARG . 7.1 mp0 -81.49 121.14 25.91 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.804 0.842 . . . . 0.0 109.591 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 47.1 t80 -139.6 154.1 47.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.456 0.702 . . . . 0.0 109.635 179.156 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 65.5 t -77.68 116.87 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.086 0.555 . . . . 0.0 110.926 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.446 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.2 p -92.55 142.0 13.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 123.863 0.865 . . . . 0.0 110.66 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -79.64 -57.85 3.47 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.173 0.989 . . . . 0.0 110.848 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -160.81 169.39 22.8 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.794 0.438 . . . . 0.0 111.866 -175.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.456 HG12 ' HB3' ' A' ' 20' ' ' TYR . 43.9 t -92.17 141.45 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.061 0.944 . . . . 0.0 109.194 171.057 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.1 mt -111.43 -35.4 5.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.508 1.123 . . . . 0.0 110.786 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -157.26 164.62 37.49 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.434 0.694 . . . . 0.0 109.812 -173.299 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -132.7 154.02 50.56 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.985 0.914 . . . . 0.0 109.971 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.24 161.47 40.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.956 0.902 . . . . 0.0 109.28 174.788 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t -116.87 124.19 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 169.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.0 t -112.49 108.83 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 176.384 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 36.6 m-80 64.97 -73.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.153 1.381 . . . . 0.0 111.033 -172.961 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -147.72 -9.34 0.2 Allowed Glycine 0 CA--C 1.528 0.852 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.607 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.423 ' HE2' ' HB3' ' A' ' 36' ' ' PRO . 15.6 ptmt -81.28 170.47 16.02 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.543 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 99.1 t -124.51 127.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.139 0.576 . . . . 0.0 109.497 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -118.33 139.52 51.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.456 ' HB3' HG12 ' A' ' 8' ' ' VAL . 98.0 m-85 -111.28 132.66 54.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.293 1.037 . . . . 0.0 109.641 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -78.42 108.56 11.86 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.8 mt -101.41 123.04 44.84 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.34 0.656 . . . . 0.0 112.169 -168.065 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -78.07 110.13 12.76 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 165.737 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.543 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 71.9 m95 -80.7 148.95 29.94 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 122.862 0.465 . . . . 0.0 110.342 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.589 ' HD3' ' HD3' ' B' ' 4' ' ' LYS . 33.2 ttpt -58.52 -48.44 80.84 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 123.67 0.606 . . . . 0.0 110.94 178.835 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.76 15.3 52.61 Favored Glycine 0 C--N 1.34 0.805 0 CA-C-N 115.584 -0.735 . . . . 0.0 114.207 -173.374 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.543 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 55.5 m-85 -132.83 136.64 46.38 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 117.605 0.702 . . . . 0.0 109.925 175.267 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.5 p -80.71 -179.22 7.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.292 1.037 . . . . 0.0 111.835 -175.662 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -49.83 -51.45 39.83 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.135 1.374 . . . . 0.0 113.582 -170.313 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.12 -20.84 62.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.419 ' HB3' ' HB3' ' A' ' 27' ' ' PHE . 11.1 t70 -91.25 -17.85 25.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.833 0.453 . . . . 0.0 111.209 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -58.17 136.99 57.36 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.479 0.712 . . . . 0.0 111.672 -177.93 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' THR . . . . . 0.509 HG22 HM11 ' B' ' 9' ' ' M3L . 33.8 p -128.41 156.79 42.6 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.372 0.669 . . . . 0.0 112.669 -166.758 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -80.32 117.53 21.16 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.095 0.958 . . . . 0.0 110.369 173.618 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -118.66 135.52 23.72 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 123.006 0.523 . . . . 0.0 110.311 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.493 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . 94.9 Cg_endo -74.55 150.94 41.29 Favored 'Trans proline' 0 C--N 1.365 1.425 0 C-N-CA 122.463 2.109 . . . . 0.0 112.511 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -27.69 64.46 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.032 0.933 . . . . 0.0 112.572 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.493 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 15.7 pt-20 -60.7 -35.75 77.08 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.199 0.6 . . . . 0.0 110.94 177.326 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -83.51 -34.78 25.24 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.788 0.835 . . . . 0.0 111.149 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.51 HD12 HD13 ' A' ' 46' ' ' ILE . 19.2 mt -62.78 136.75 58.03 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -170.172 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -108.57 29.52 7.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 171.731 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.466 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 19.7 m -116.27 89.51 26.39 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.262 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.97 -26.48 6.58 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.742 1.628 . . . . 0.0 111.097 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.51 -56.14 13.99 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 124.328 1.051 . . . . 0.0 111.127 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.529 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 83.9 mt -65.95 -40.26 91.17 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.677 0.61 . . . . 0.0 111.638 -174.012 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.51 HD13 HD12 ' A' ' 40' ' ' LEU . 76.5 mt -66.36 -47.94 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.472 0.483 . . . . 0.0 110.54 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.34 -50.85 72.16 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.317 0.647 . . . . 0.0 110.794 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -37.25 85.92 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.534 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -64.2 -49.75 70.79 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.132 0.973 . . . . 0.0 110.805 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 80.0 mt -66.24 -38.61 88.3 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.904 -177.728 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -78.16 -18.32 55.71 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.8 t -76.56 -28.66 56.34 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 120.898 0.38 . . . . 0.0 110.016 174.162 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 45.3 mt-30 -83.02 -37.56 23.77 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.707 0.803 . . . . 0.0 110.327 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm . . . . . 0 CA--C 1.547 0.848 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.892 179.717 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -19.85 59.24 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 122.66 0.384 . . . . 0.0 110.094 172.629 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 24.7 m -63.48 83.56 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.131 0.972 . . . . 0.0 109.66 175.4 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.589 ' HD3' ' HD3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -144.62 114.29 7.21 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.66 1.184 . . . . 0.0 109.073 -172.35 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.529 ' HG3' ' HG ' ' A' ' 45' ' ' LEU . 87.4 mm-40 -94.24 156.3 16.61 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.281 0.632 . . . . 0.0 110.556 -178.275 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 37.4 m -110.63 137.35 48.43 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.534 0.733 . . . . 0.0 109.24 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -129.1 145.47 51.28 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.866 0.866 . . . . 0.0 108.988 176.604 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.691 ' HG2' ' HG3' ' A' ' 2' ' ' GLU . 67.2 mtt85 -105.6 139.93 39.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.852 -172.585 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.509 HM11 HG22 ' A' ' 33' ' ' THR . . . . . . . . 0 C--O 1.244 0.764 0 C-N-CA 123.34 0.656 . . . . 0.0 109.271 173.571 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 22.3 t -65.85 168.3 8.18 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.603 0.761 . . . . 0.0 111.168 174.587 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 75.4 p 50.81 75.85 0.17 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.89 1.276 . . . . 0.0 110.917 -173.356 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.32 -101.04 0.24 Allowed Glycine 0 C--N 1.342 0.898 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.539 -174.034 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 68.97 11.42 63.35 Favored Glycine 0 C--N 1.348 1.218 0 O-C-N 123.688 0.287 . . . . 0.0 113.562 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.32 118.3 9.4 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.367 1.067 . . . . 0.0 109.278 -175.572 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . 0.449 ' HB2' ' HG2' ' A' ' 2' ' ' GLU . . . . . . . . 0 C--O 1.251 1.182 0 C-N-CA 123.74 0.816 . . . . 0.0 108.966 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.803 0 N-CA-C 112.299 -0.321 . . . . 0.0 112.299 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -76.77 164.34 25.95 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.241 0.616 . . . . 0.0 109.508 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -81.72 114.91 20.7 Favored 'General case' 0 C--N 1.349 0.554 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -169.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.49 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 47.0 t -84.35 132.08 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 176.192 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.476 HG23 HD22 ' A' ' 22' ' ' LEU . 1.2 p -100.88 121.8 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 109.325 -0.621 . . . . 0.0 109.325 172.461 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.575 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 14.8 tp10 -53.59 -57.22 11.52 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.554 1.142 . . . . 0.0 110.821 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -164.21 162.03 22.42 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 -174.26 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.503 HG12 ' HB3' ' A' ' 20' ' ' TYR . 85.9 t -85.28 116.71 29.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.599 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.1 mt -82.9 -35.69 25.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.013 0.525 . . . . 0.0 111.888 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -164.56 162.73 21.84 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.259 0.349 . . . . 0.0 110.995 -171.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.477 ' NH2' HD23 ' A' ' 50' ' ' LEU . 31.3 ttm180 -118.59 149.26 41.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.309 1.044 . . . . 0.0 109.539 173.538 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -132.2 160.78 35.12 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 165.651 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 85.9 t -120.95 108.46 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 167.327 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.61 128.56 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.371 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 66.02 22.2 11.23 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.843 1.257 . . . . 0.0 111.772 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.45 6.08 89.05 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.781 -0.645 . . . . 0.0 113.357 -176.056 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -104.26 143.13 33.37 Favored 'General case' 0 C--N 1.348 0.523 0 C-N-CA 124.285 1.034 . . . . 0.0 109.702 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -91.08 119.45 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.402 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.508 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 43.0 mt-10 -128.19 162.71 26.34 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.144 0.978 . . . . 0.0 109.576 -178.919 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.503 ' HB3' HG12 ' A' ' 8' ' ' VAL . 87.7 m-85 -140.68 134.45 30.39 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.528 0.731 . . . . 0.0 110.147 -172.56 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -78.51 106.94 10.81 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 174.502 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.586 HD12 HD21 ' A' ' 40' ' ' LEU . 28.4 mt -87.98 123.35 32.6 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.351 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -78.11 99.45 6.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.052 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.534 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 63.0 m95 -63.88 126.26 27.05 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 171.427 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.575 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 38.0 ttpt -51.21 -54.44 25.59 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.411 1.484 . . . . 0.0 113.516 -164.589 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.75 30.69 9.78 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 116.78 -0.191 . . . . 0.0 112.855 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.534 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.6 m-85 -135.55 142.21 45.33 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.375 0.67 . . . . 0.0 110.234 -178.859 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.8 p -64.75 159.24 22.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.251 1.02 . . . . 0.0 112.141 -175.506 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.23 -34.81 78.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.298 0.639 . . . . 0.0 112.064 -177.005 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.82 -19.3 64.27 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.424 0.69 . . . . 0.0 111.546 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -99.82 -18.4 17.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.452 1.101 . . . . 0.0 110.844 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.479 ' HB3' ' O ' ' A' ' 22' ' ' LEU . 11.8 m120 -68.11 146.61 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.195 0.598 . . . . 0.0 111.183 175.821 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 42.7 p -126.07 165.06 19.54 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.32 0.648 . . . . 0.0 112.358 -166.333 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -88.4 116.9 26.95 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.993 0.917 . . . . 0.0 109.847 173.089 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -121.8 133.62 24.35 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 123.688 0.795 . . . . 0.0 110.744 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.508 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 58.2 Cg_endo -69.26 156.07 65.72 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.591 2.194 . . . . 0.0 111.667 176.472 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.421 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -51.49 -30.16 19.08 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.367 1.067 . . . . 0.0 113.43 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.42 -37.91 80.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.336 0.654 . . . . 0.0 110.983 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -89.83 3.26 53.49 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.491 0.717 . . . . 0.0 111.1 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.586 HD21 HD12 ' A' ' 22' ' ' LEU . 10.8 mt -88.66 124.25 33.9 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.994 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.45 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 32.5 t70 -84.1 -33.57 24.32 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 175.946 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.545 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 17.6 p -71.57 109.44 5.52 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 124.403 1.081 . . . . 0.0 110.839 174.364 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.45 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 73.4 Cg_endo -87.12 -19.39 2.52 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.253 1.968 . . . . 0.0 111.953 170.923 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.57 -35.58 60.57 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.932 0.893 . . . . 0.0 110.789 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.2 mt -69.98 -32.63 70.94 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.614 0.366 . . . . 0.0 110.865 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 29.3 mt -68.49 -46.56 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.13 -45.23 94.36 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.51 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.74 -32.14 73.25 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.173 0.589 . . . . 0.0 111.627 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.45 -40.19 96.48 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.85 0.86 . . . . 0.0 110.501 173.08 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.477 HD23 ' NH2' ' A' ' 11' ' ' ARG . 91.4 mt -73.22 -34.79 66.11 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.363 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . 0.444 ' HA ' ' HB2' ' A' ' 54' ' ' LYS . 91.0 m-20 -76.7 -14.97 59.91 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.835 0.854 . . . . 0.0 111.084 179.578 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.3 t -70.48 -37.21 74.22 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.868 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -78.06 -34.94 50.12 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.987 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.444 ' HB2' ' HA ' ' A' ' 51' ' ' ASN . 30.4 mmmt . . . . . 0 C--O 1.251 1.178 0 C-N-CA 124.076 0.951 . . . . 0.0 110.312 -176.366 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 57.78 28.5 16.02 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 124.179 0.991 . . . . 0.0 111.468 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 39.6 p -76.47 91.45 3.33 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 124.003 0.921 . . . . 0.0 110.74 -172.415 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -80.52 79.51 7.11 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.246 1.022 . . . . 0.0 110.281 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.545 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 46.1 tt0 -140.73 19.0 2.34 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 114.145 -1.389 . . . . 0.0 108.563 177.889 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.49 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 21.8 p -96.27 179.42 5.05 Favored 'General case' 0 C--O 1.246 0.92 0 C-N-CA 124.284 1.033 . . . . 0.0 111.55 -176.425 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -176.97 179.97 0.98 Allowed 'General case' 0 C--O 1.246 0.912 0 C-N-CA 125.336 1.454 . . . . 0.0 108.71 177.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.1 ttp85 -128.29 156.05 43.65 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.805 0.842 . . . . 0.0 108.839 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.435 0 C-N-CA 122.779 0.432 . . . . 0.0 110.522 175.295 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 31.3 p -74.25 151.04 39.98 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.178 0.991 . . . . 0.0 110.31 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 52.8 p -90.06 31.28 0.99 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 110.183 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -68.36 -48.76 49.81 Favored Glycine 0 C--N 1.355 1.638 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.324 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 69.25 -83.69 0.25 Allowed Glycine 0 C--N 1.354 1.539 0 C-N-CA 123.209 0.433 . . . . 0.0 112.691 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -83.11 -21.88 33.53 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.106 0.963 . . . . 0.0 110.101 174.979 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.144 0 C-N-CA 123.566 0.746 . . . . 0.0 110.277 173.929 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.529 0 N-CA-C 111.896 -0.482 . . . . 0.0 111.896 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -91.06 115.77 28.28 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 173.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -117.26 142.26 47.28 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.391 0.677 . . . . 0.0 110.14 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.4 HG12 ' HB3' ' A' ' 25' ' ' LYS . 6.0 p -75.65 122.5 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.58 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.526 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -97.26 134.9 33.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 123.657 0.783 . . . . 0.0 109.427 175.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.0 -55.98 9.18 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.003 0.921 . . . . 0.0 109.752 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -162.92 166.75 23.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.443 0.697 . . . . 0.0 110.875 -174.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 60.0 t -90.41 142.34 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 169.941 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.7 mt -106.77 -45.58 4.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.707 0.803 . . . . 0.0 111.058 -178.808 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -149.6 161.85 41.35 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.811 0.339 . . . . 0.0 110.933 -175.559 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -122.42 151.87 40.8 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.092 1.357 . . . . 0.0 108.605 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -153.23 163.58 39.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.123 0.569 . . . . 0.0 110.272 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.2 t -117.59 115.11 47.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 123.961 0.904 . . . . 0.0 109.178 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.41 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 88.6 t -116.45 109.85 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.362 1.065 . . . . 0.0 109.47 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.8 m120 60.93 17.92 8.32 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 124.303 1.041 . . . . 0.0 112.851 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.91 -24.38 14.93 Favored Glycine 0 C--N 1.347 1.159 0 CA-C-O 119.829 -0.428 . . . . 0.0 113.367 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.41 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptmt -81.92 170.98 14.99 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.951 0.5 . . . . 0.0 109.823 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -120.54 118.57 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.229 0.612 . . . . 0.0 110.214 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.584 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 61.6 mt-10 -111.02 152.23 27.09 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.809 0.844 . . . . 0.0 110.687 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.426 ' HE1' ' HB3' ' A' ' 37' ' ' GLU . 94.0 m-85 -130.09 126.9 38.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.651 1.18 . . . . 0.0 109.268 -176.216 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -78.32 108.35 11.6 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.447 HD11 HD21 ' A' ' 40' ' ' LEU . 39.9 mt -90.29 122.39 33.15 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 -174.225 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.37 96.79 6.11 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 163.189 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.544 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.5 m95 -67.88 135.27 52.23 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.364 0.415 . . . . 0.0 110.241 179.231 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.4 ' HB3' HG12 ' A' ' 4' ' ' VAL . 24.9 ttmm -69.92 131.25 44.13 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 175.089 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.9 -35.27 3.82 Favored Glycine 0 C--N 1.347 1.145 0 O-C-N 123.314 0.384 . . . . 0.0 112.903 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.544 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 64.6 m-85 -91.65 144.74 25.21 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.636 0.775 . . . . 0.0 109.875 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.1 p -73.77 163.37 28.05 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.861 0.864 . . . . 0.0 112.1 -174.173 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.425 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.9 p-10 -59.55 -33.76 71.82 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.846 0.858 . . . . 0.0 111.389 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.03 -28.1 60.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.846 0.858 . . . . 0.0 111.839 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -88.51 -11.87 44.53 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.491 0.716 . . . . 0.0 111.25 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.542 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.8 m120 -63.25 157.66 22.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.1 p -143.65 154.67 43.76 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.488 0.715 . . . . 0.0 111.403 -172.707 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -77.54 124.02 27.37 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.899 0.88 . . . . 0.0 109.139 171.787 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -124.68 129.63 24.55 Favored Pre-proline 0 N--CA 1.468 0.458 0 C-N-CA 123.15 0.58 . . . . 0.0 110.761 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.584 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 51.4 Cg_endo -66.7 159.82 49.35 Favored 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.685 2.257 . . . . 0.0 111.91 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.426 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -64.69 -24.77 67.68 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.551 0.74 . . . . 0.0 112.786 -176.277 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.02 -31.45 72.64 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.961 0.904 . . . . 0.0 110.624 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.03 -12.86 32.02 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.525 1.13 . . . . 0.0 111.216 -172.6 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.447 HD21 HD11 ' A' ' 22' ' ' LEU . 21.5 mt -86.53 120.97 28.43 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.502 0.721 . . . . 0.0 110.346 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . 0.477 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 26.9 t70 -83.08 -30.1 28.26 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 173.451 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.1 p -78.23 106.29 3.87 Favored Pre-proline 0 CA--C 1.559 1.319 0 C-N-CA 124.8 1.24 . . . . 0.0 112.164 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.477 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 64.8 Cg_endo -87.96 -18.51 2.31 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.736 2.291 . . . . 0.0 113.064 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . 0.422 ' HB3' ' OE1' ' B' ' 5' ' ' GLN . 35.2 tt0 -75.25 -36.22 61.3 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.722 0.809 . . . . 0.0 110.441 -174.976 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -67.22 -39.7 86.3 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.113 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.494 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 62.7 mt -63.39 -47.55 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 176.548 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.97 -53.27 60.25 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.264 1.026 . . . . 0.0 111.296 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.92 -33.63 74.6 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.609 0.764 . . . . 0.0 111.109 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -71.34 -36.87 71.69 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.169 0.988 . . . . 0.0 111.421 176.228 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.494 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 96.8 mt -67.83 -36.72 80.85 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 176.537 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -67.27 -28.41 68.01 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.256 1.022 . . . . 0.0 110.529 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.9 m -74.81 -38.04 62.19 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.198 0.599 . . . . 0.0 110.557 175.58 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.49 ' NE2' HD22 ' A' ' 50' ' ' LEU . 46.5 mt-30 -70.16 -35.51 74.06 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.803 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? . . . . . 0 CA--C 1.549 0.928 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -176.862 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -65.08 -67.38 0.44 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 176.198 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 43.2 p -86.42 150.38 24.34 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.069 0.547 . . . . 0.0 109.574 174.048 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -73.81 135.57 43.49 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 170.393 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.422 ' OE1' ' HB3' ' A' ' 44' ' ' GLU . 33.3 mm-40 -62.72 97.17 0.1 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.887 0.742 . . . . 0.0 111.053 -172.905 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 8.8 t -127.22 159.87 32.99 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 123.81 0.844 . . . . 0.0 110.43 -173.599 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -156.55 163.83 38.92 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.987 1.315 . . . . 0.0 108.094 173.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.463 ' HD2' ' N ' ' B' ' 8' ' ' ARG . 1.8 mpt_? -101.92 176.94 5.04 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.797 0 O-C-N 122.04 -0.412 . . . . 0.0 110.022 175.122 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 22.8 t -59.89 108.55 0.77 Allowed 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.096 1.358 . . . . 0.0 110.693 -170.004 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 23.7 m -71.31 100.21 2.09 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.009 -177.909 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.66 135.18 17.68 Favored Glycine 0 C--N 1.342 0.902 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.791 -177.723 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -94.1 93.54 1.7 Allowed Glycine 0 C--N 1.346 1.107 0 C-N-CA 123.328 0.49 . . . . 0.0 112.051 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -79.99 73.01 6.79 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.597 0.759 . . . . 0.0 109.437 175.051 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.887 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.584 -173.801 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.766 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -104.41 -44.71 4.86 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.037 0.935 . . . . 0.0 111.2 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -110.17 119.36 39.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.798 0.839 . . . . 0.0 109.921 -167.267 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.469 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 18.9 t -78.44 134.0 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 122.75 0.42 . . . . 0.0 110.613 -174.553 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.441 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -112.92 135.82 51.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.865 1.266 . . . . 0.0 110.285 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.681 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 18.1 tp10 -70.05 -54.82 11.42 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.924 1.29 . . . . 0.0 110.962 175.842 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.681 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.19 169.08 5.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.034 0.934 . . . . 0.0 111.104 170.827 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.5 t -77.16 141.26 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.966 172.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.1 mt -109.34 -41.15 4.71 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.645 0.778 . . . . 0.0 111.179 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -147.12 164.28 33.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.886 0.474 . . . . 0.0 110.322 -169.333 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -132.89 151.63 52.0 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.423 1.089 . . . . 0.0 110.137 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -148.68 163.89 35.96 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.219 1.007 . . . . 0.0 109.522 174.16 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.422 ' HA ' ' O ' ' A' ' 17' ' ' LYS . 57.0 t -115.99 108.37 24.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 170.08 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.1 t -91.34 110.2 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.5 m120 66.68 -73.3 0.08 Allowed 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.955 1.302 . . . . 0.0 111.201 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -160.26 34.66 0.43 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 175.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.422 ' O ' ' HA ' ' A' ' 13' ' ' VAL . 12.4 ptmt -130.82 151.54 51.14 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.469 0.708 . . . . 0.0 109.601 177.509 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 95.3 t -90.54 130.15 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 122.634 0.374 . . . . 0.0 110.19 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.45 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 25.9 mt-10 -124.97 149.05 48.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 109.739 170.379 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.493 ' HB2' HD11 ' A' ' 40' ' ' LEU . 92.4 m-85 -122.93 132.59 54.23 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.22 1.008 . . . . 0.0 110.026 -178.561 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -78.12 109.38 12.16 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.194 0.997 . . . . 0.0 108.778 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.486 HD13 HD22 ' A' ' 40' ' ' LEU . 20.6 mt -88.81 126.07 35.19 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.06 0.544 . . . . 0.0 111.139 -176.488 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -80.0 107.43 12.78 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 162.181 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.522 ' CD1' ' HA ' ' A' ' 32' ' ' ASN . 90.3 m95 -72.33 134.38 45.46 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.591 0.356 . . . . 0.0 110.795 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -69.83 -60.78 2.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.844 0.858 . . . . 0.0 111.158 -173.067 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.76 32.84 6.38 Favored Glycine 0 C--N 1.344 0.976 0 CA-C-N 115.774 -0.648 . . . . 0.0 113.321 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.405 ' HD2' ' HB3' ' A' ' 24' ' ' TRP . 85.4 m-85 -137.27 163.91 29.8 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.124 0.969 . . . . 0.0 108.689 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.7 t -72.57 164.96 25.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.096 0.558 . . . . 0.0 111.619 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -73.12 -42.95 62.36 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.662 0.785 . . . . 0.0 112.692 -165.317 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.53 -13.66 60.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.986 0.515 . . . . 0.0 111.858 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -79.35 -10.89 59.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.218 1.007 . . . . 0.0 111.994 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.522 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 9.9 m120 -64.99 136.13 56.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.117 0.567 . . . . 0.0 112.319 -174.429 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.3 p -138.4 162.29 34.79 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.249 0.62 . . . . 0.0 112.341 -165.632 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -79.0 123.11 26.98 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.515 1.126 . . . . 0.0 111.123 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.414 ' OE1' ' HA ' ' B' ' 9' ' ' M3L . 57.2 mm-40 -121.65 135.1 24.88 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 171.913 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.45 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 38.5 Cg_endo -65.35 155.87 66.33 Favored 'Trans proline' 0 C--N 1.372 1.764 0 C-N-CA 122.329 2.019 . . . . 0.0 111.333 175.046 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.01 -26.24 62.13 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.74 0.816 . . . . 0.0 112.502 -178.923 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.412 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 10.4 pt-20 -71.64 -27.94 63.43 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.451 0.701 . . . . 0.0 110.841 178.63 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.486 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.7 m-20 -88.7 -16.37 32.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.924 0.89 . . . . 0.0 111.43 177.636 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.493 HD11 ' HB2' ' A' ' 20' ' ' TYR . 23.6 mt -77.28 124.9 28.48 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.723 0.409 . . . . 0.0 110.362 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.97 24.0 12.82 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 p -121.29 89.11 46.45 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 123.652 0.781 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . 0.409 ' HD2' HE22 ' B' ' 5' ' ' GLN . 29.0 Cg_exo -65.35 -48.17 3.64 Favored 'Trans proline' 0 C--N 1.376 1.982 0 C-N-CA 123.063 2.509 . . . . 0.0 113.736 -177.44 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -64.42 -29.57 70.62 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.696 0.799 . . . . 0.0 112.165 -173.738 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.44 HD12 ' HA ' ' A' ' 7' ' ' LYS . 53.1 mt -78.04 -35.84 49.24 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.399 0.68 . . . . 0.0 111.426 -176.669 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 71.6 mt -65.2 -47.51 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.41 -46.02 80.39 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.191 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.13 84.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.028 0.931 . . . . 0.0 110.923 -176.054 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -68.16 -46.35 71.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.918 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.23 -24.25 63.06 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.321 0.649 . . . . 0.0 110.178 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -74.78 -25.75 59.28 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.622 1.169 . . . . 0.0 109.853 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.2 m -72.13 -27.16 62.43 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.52 172.924 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -80.92 -13.32 59.02 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.014 0.926 . . . . 0.0 110.887 173.187 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? . . . . . 0 C--O 1.251 1.158 0 C-N-CA 124.462 1.105 . . . . 0.0 109.765 -178.853 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 76.19 -49.85 0.59 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 125.515 1.526 . . . . 0.0 112.919 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 4.6 t -54.13 94.68 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.333 1.053 . . . . 0.0 111.951 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.461 ' HZ1' ' HB2' ' B' ' 4' ' ' LYS . 3.9 ttmp? -81.1 83.06 6.86 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.116 178.922 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.409 HE22 ' HD2' ' A' ' 43' ' ' PRO . 16.0 mm-40 -72.57 117.97 14.9 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.205 178.85 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.469 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 10.1 t -131.94 179.12 6.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.349 -165.508 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.89 -179.61 8.22 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.84 0.856 . . . . 0.0 110.635 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.486 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 76.6 ttt180 -130.27 129.11 42.86 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.082 1.353 . . . . 0.0 107.698 -173.072 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.414 ' HA ' ' OE1' ' A' ' 35' ' ' GLU . . . . . . . . 0 N--CA 1.484 1.264 0 CA-C-N 118.912 0.778 . . . . 0.0 112.609 -174.926 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 39.9 m -143.43 144.94 32.23 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.07 0.548 . . . . 0.0 109.655 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 49.1 m -71.59 85.5 0.88 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -101.59 117.0 5.71 Favored Glycine 0 C--N 1.35 1.31 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.867 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -101.99 -87.32 1.98 Allowed Glycine 0 C--N 1.347 1.184 0 N-CA-C 110.303 -1.119 . . . . 0.0 110.303 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -157.91 -80.95 0.06 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.541 0.737 . . . . 0.0 109.651 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.108 0 C-N-CA 123.716 0.806 . . . . 0.0 109.372 -177.701 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.483 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.442 ' HG2' ' HA ' ' B' ' 8' ' ' ARG . 9.5 pt-20 -137.45 -17.82 1.3 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.21 0.604 . . . . 0.0 111.77 -179.024 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -141.27 136.59 31.77 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.259 0.624 . . . . 0.0 110.311 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 30.6 m -73.45 134.86 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.567 0.747 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.415 HG23 HD21 ' A' ' 22' ' ' LEU . 1.7 p -125.79 133.5 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.511 0.724 . . . . 0.0 110.014 174.838 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.805 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 10.6 tp10 -56.11 -64.84 0.73 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.364 1.466 . . . . 0.0 110.58 172.875 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.805 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.83 170.12 4.68 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.313 1.045 . . . . 0.0 110.689 169.831 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 49' ' ' PHE . 63.4 t -66.07 139.55 21.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.07 172.033 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . 0.438 HD12 ' HB2' ' A' ' 23' ' ' LYS . 86.3 mt -111.63 -30.14 7.46 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 123.78 0.832 . . . . 0.0 110.865 -177.869 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -159.43 163.39 35.46 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.638 0.375 . . . . 0.0 110.702 -172.905 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -136.33 147.69 47.53 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.103 0.961 . . . . 0.0 110.397 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -151.09 172.72 15.32 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.473 1.109 . . . . 0.0 108.821 174.593 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -129.98 118.54 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.518 0.727 . . . . 0.0 109.273 174.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.1 t -125.98 123.82 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.078 0.951 . . . . 0.0 109.335 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.9 m120 62.99 26.72 15.64 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.763 1.225 . . . . 0.0 111.969 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.76 -23.5 30.48 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.269 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -77.66 148.95 34.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.711 1.205 . . . . 0.0 109.458 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.9 t -106.12 116.06 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.637 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -104.41 154.62 19.63 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 110.261 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 91.1 m-85 -138.48 124.27 19.86 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.484 1.114 . . . . 0.0 109.519 -175.327 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -78.5 109.3 12.55 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.415 HD21 HG23 ' A' ' 5' ' ' VAL . 54.2 mt -96.36 127.66 42.56 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.613 0.765 . . . . 0.0 111.209 -172.849 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.438 ' HB2' HD12 ' A' ' 9' ' ' LEU . 3.4 tmtp? -80.11 96.87 6.63 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 167.18 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.554 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 92.5 m95 -63.95 117.58 7.22 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.4 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.414 ' HE2' ' HE2' ' B' ' 4' ' ' LYS . 13.1 ttpp -66.11 -34.19 77.5 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 124.22 0.95 . . . . 0.0 111.829 -168.571 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.73 16.95 60.13 Favored Glycine 0 C--N 1.343 0.965 0 CA-C-N 115.977 -0.556 . . . . 0.0 113.604 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.423 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 98.7 m-85 -139.01 157.57 45.76 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.662 0.785 . . . . 0.0 110.058 -177.437 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 t -69.09 162.54 26.73 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.274 0.63 . . . . 0.0 111.865 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.68 -34.42 78.17 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.854 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.87 -22.34 60.79 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.088 0.555 . . . . 0.0 111.663 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -88.72 -3.78 58.69 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.833 0.853 . . . . 0.0 110.883 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.554 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.7 m120 -70.03 138.35 52.07 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.06 0.544 . . . . 0.0 111.079 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.0 p -130.36 165.26 22.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.37 0.668 . . . . 0.0 111.821 -170.198 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -83.95 116.41 22.78 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.059 0.944 . . . . 0.0 110.146 173.653 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -117.14 131.56 23.94 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 123.074 0.549 . . . . 0.0 110.116 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.637 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.5 Cg_endo -66.5 165.3 25.56 Favored 'Trans proline' 0 C--N 1.367 1.542 0 C-N-CA 122.392 2.061 . . . . 0.0 113.001 175.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.429 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.22 -29.14 67.3 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.255 1.022 . . . . 0.0 112.546 -178.464 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.35 -34.03 76.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.749 0.819 . . . . 0.0 110.984 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -77.11 -33.64 56.86 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.568 0.747 . . . . 0.0 111.156 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.429 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 34.9 mt -62.08 124.98 22.3 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.517 0.327 . . . . 0.0 111.259 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -108.23 19.54 19.77 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 122.653 1.216 . . . . 0.0 108.151 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.432 ' O ' HG13 ' A' ' 46' ' ' ILE . 12.9 p -127.69 87.52 55.75 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.398 -176.725 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.87 -27.32 26.11 Favored 'Trans proline' 0 C--N 1.377 2.058 0 C-N-CA 122.491 2.127 . . . . 0.0 111.786 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.15 -38.64 82.36 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.696 0.798 . . . . 0.0 111.187 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.513 HD13 ' HA ' ' A' ' 7' ' ' LYS . 77.6 mt -78.73 -23.59 45.37 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.259 0.624 . . . . 0.0 111.312 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.432 HG13 ' O ' ' A' ' 42' ' ' CYS . 79.9 mt -67.3 -52.39 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 169.261 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.16 -44.8 79.63 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.401 1.081 . . . . 0.0 110.994 177.898 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.52 -43.98 97.89 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.64 -177.909 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.468 ' HB2' ' HB ' ' A' ' 8' ' ' VAL . 43.4 t80 -59.43 -47.86 83.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 124.282 0.988 . . . . 0.0 111.102 177.054 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.42 -38.59 84.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.442 0.697 . . . . 0.0 110.548 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.91 -24.63 59.72 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.616 0.766 . . . . 0.0 111.284 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 52.5 m -82.2 -20.3 38.05 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.266 0.626 . . . . 0.0 111.388 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 44.6 mt-30 -73.76 -70.78 0.36 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 122.541 0.336 . . . . 0.0 110.527 178.117 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp . . . . . 0 N--CA 1.484 1.227 0 C-N-CA 124.478 1.111 . . . . 0.0 110.95 -175.938 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -99.43 97.26 8.31 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.071 0.548 . . . . 0.0 109.622 175.743 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 21.0 m -107.09 150.09 26.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.467 0.707 . . . . 0.0 109.698 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.414 ' HE2' ' HE2' ' A' ' 25' ' ' LYS . 16.5 ptpt -102.38 34.85 2.61 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.951 0.9 . . . . 0.0 110.918 176.668 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -69.08 141.66 54.68 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.007 178.353 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 42.8 p -93.2 170.89 9.29 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 122.492 1.139 . . . . 0.0 113.808 -164.901 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.27 -179.82 7.67 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-N 113.737 -1.574 . . . . 0.0 108.692 172.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.442 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 31.7 ttm180 -114.4 153.74 29.33 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.601 0.761 . . . . 0.0 109.716 -175.798 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.715 0 C-N-CA 123.006 0.522 . . . . 0.0 110.106 171.344 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 51.0 p -113.97 88.37 2.83 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.685 -170.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.4 m -74.81 -35.73 62.46 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.632 0.773 . . . . 0.0 109.574 168.664 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 90.18 -60.93 3.35 Favored Glycine 0 C--N 1.341 0.807 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.92 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 90.04 -53.96 3.62 Favored Glycine 0 C--N 1.347 1.148 0 N-CA-C 111.807 -0.517 . . . . 0.0 111.807 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -161.46 -50.65 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.541 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.134 0 CA-C-N 115.232 -0.894 . . . . 0.0 108.843 177.639 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.453 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -76.87 132.24 39.03 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 -178.512 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -82.53 122.44 28.07 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -168.634 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.2 t -75.83 130.55 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.502 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -106.57 119.61 56.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.292 0.637 . . . . 0.0 109.927 174.644 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.434 ' HG3' ' HG2' ' A' ' 7' ' ' LYS . 11.7 tp10 -48.35 -57.17 6.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.747 1.619 . . . . 0.0 110.989 172.089 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.434 ' HG2' ' HG3' ' A' ' 6' ' ' GLU . 3.6 ptpp? -170.36 156.94 5.87 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.72 0.808 . . . . 0.0 110.929 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.43 HG13 ' HB3' ' A' ' 20' ' ' TYR . 85.3 t -71.85 120.27 19.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.869 169.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -87.75 -49.42 7.14 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.265 0.626 . . . . 0.0 110.841 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -147.8 164.88 32.25 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 -170.976 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -137.54 134.73 36.01 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.286 1.034 . . . . 0.0 109.605 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -138.52 175.75 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.325 0.65 . . . . 0.0 109.907 177.004 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -123.18 123.67 68.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 108.452 174.01 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 75.9 t -133.64 122.05 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.766 0.826 . . . . 0.0 109.175 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 66.54 19.67 10.85 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.928 1.291 . . . . 0.0 111.694 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.8 -19.74 53.11 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.923 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -81.66 166.28 20.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.831 0.453 . . . . 0.0 109.85 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.8 t -114.42 110.55 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 123.774 0.83 . . . . 0.0 108.911 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.528 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 95.7 mt-10 -104.53 156.1 18.24 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.62 0.768 . . . . 0.0 110.475 -177.726 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.43 ' HB3' HG13 ' A' ' 8' ' ' VAL . 48.0 m-85 -134.9 124.06 24.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.391 1.077 . . . . 0.0 108.444 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -76.72 107.68 9.2 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.532 HD13 HD21 ' A' ' 40' ' ' LEU . 43.0 mt -92.65 123.69 36.12 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.344 -174.632 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -77.38 98.97 5.42 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.607 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 82.9 m95 -67.54 122.01 17.08 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 173.84 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -66.7 -26.99 67.28 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 123.643 0.589 . . . . 0.0 111.905 -175.399 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.28 -7.8 82.35 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-N 116.379 -0.373 . . . . 0.0 113.661 179.471 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -129.44 162.84 27.16 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.593 0.757 . . . . 0.0 110.784 -174.069 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.8 p -73.14 161.63 30.38 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.387 0.675 . . . . 0.0 110.861 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.478 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 21.0 m-20 -57.8 -36.39 72.14 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.576 0.547 . . . . 0.0 110.999 177.902 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.88 -18.0 60.5 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.034 0.934 . . . . 0.0 112.542 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -99.12 -8.1 25.69 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.408 0.283 . . . . 0.0 111.365 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.607 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.9 m120 -65.74 158.55 27.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.452 0.701 . . . . 0.0 112.584 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.0 p -140.76 158.76 43.49 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 121.403 0.621 . . . . 0.0 112.304 -173.494 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -80.67 123.24 28.0 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.862 1.265 . . . . 0.0 109.828 173.525 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -123.3 133.41 24.52 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 122.849 0.46 . . . . 0.0 110.142 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.528 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 56.0 Cg_endo -66.98 156.97 63.92 Favored 'Trans proline' 0 C--N 1.371 1.747 0 C-N-CA 122.911 2.407 . . . . 0.0 112.12 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.405 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -56.52 -31.32 63.99 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.852 0.861 . . . . 0.0 113.1 -176.779 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.66 -28.21 68.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.258 1.023 . . . . 0.0 111.736 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.433 ' OD1' ' HB3' ' B' ' 8' ' ' ARG . 57.0 t30 -89.47 -15.23 33.56 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.463 1.105 . . . . 0.0 111.082 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.532 HD21 HD13 ' A' ' 22' ' ' LEU . 28.5 mt -79.04 130.3 35.37 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.099 0.56 . . . . 0.0 110.961 -173.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -105.6 12.53 31.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.891 0.877 . . . . 0.0 109.763 175.314 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.5 p -113.16 90.3 16.07 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.234 1.014 . . . . 0.0 109.166 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.51 -29.53 1.81 Allowed 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.607 2.205 . . . . 0.0 112.958 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.92 -29.34 61.99 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.481 0.712 . . . . 0.0 111.122 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.402 ' HB3' HG21 ' A' ' 8' ' ' VAL . 32.6 mt -68.37 -30.09 68.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.528 0.331 . . . . 0.0 111.605 175.404 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 47.8 mm -71.71 -47.83 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.362 0.414 . . . . 0.0 110.343 176.405 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -54.96 -50.2 69.5 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.819 0.699 . . . . 0.0 110.386 174.756 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.36 -50.71 72.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.763 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.411 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 73.3 t80 -55.85 -50.86 69.43 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.254 1.022 . . . . 0.0 111.756 -178.425 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.439 ' HA ' HE21 ' A' ' 53' ' ' GLN . 95.9 mt -64.43 -47.5 78.89 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.606 0.762 . . . . 0.0 111.128 -176.802 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -66.16 -23.17 66.42 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.577 0.751 . . . . 0.0 111.524 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.3 m -87.46 -28.72 21.9 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.374 0.67 . . . . 0.0 112.482 -178.922 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.439 HE21 ' HA ' ' A' ' 50' ' ' LEU . 47.5 mt-30 -61.91 -33.21 73.83 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.536 0.334 . . . . 0.0 111.048 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.499 ' HZ1' ' HB2' ' A' ' 54' ' ' LYS . 0.1 OUTLIER . . . . . 0 CA--C 1.559 1.303 0 CA-C-O 117.741 -1.123 . . . . 0.0 109.751 -179.49 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 120.809 0.338 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . 0.541 ' H ' ' HD3' ' B' ' 2' ' ' ARG . 0.0 OUTLIER -60.36 -22.04 62.81 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.529 1.131 . . . . 0.0 112.025 174.788 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 3.1 p -65.77 105.06 1.18 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.801 0.841 . . . . 0.0 110.588 173.623 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -96.41 144.21 26.75 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.531 0.732 . . . . 0.0 110.93 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -80.6 75.92 7.47 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.812 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 21.8 p -134.51 169.83 16.68 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.75 0.82 . . . . 0.0 110.738 -170.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -168.26 165.39 13.04 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.864 0.866 . . . . 0.0 109.583 173.795 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.433 ' HB3' ' OD1' ' A' ' 39' ' ' ASN . 38.4 ttm-85 -96.33 178.72 5.28 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 174.37 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.729 0 O-C-N 121.82 -0.55 . . . . 0.0 111.022 173.448 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 51.1 m -75.1 -32.02 61.31 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 161.153 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 18.8 m -96.61 75.8 2.82 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 169.373 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -71.96 -14.58 76.02 Favored Glycine 0 C--N 1.348 1.237 0 CA-C-N 114.906 -1.043 . . . . 0.0 112.159 175.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 130.44 -41.62 1.51 Allowed Glycine 0 C--N 1.348 1.225 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 176.4 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -169.2 -50.23 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.671 0.788 . . . . 0.0 110.077 -176.412 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.791 -179.158 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.79 0 N-CA-C 112.219 -0.352 . . . . 0.0 112.219 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.67 108.41 3.86 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 123.699 0.8 . . . . 0.0 109.956 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.458 ' HD2' ' HA ' ' B' ' 8' ' ' ARG . 67.4 m-85 -77.15 115.71 17.17 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 178.851 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.29 115.54 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.04 -177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.552 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.1 p -98.57 130.66 47.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 124.212 1.005 . . . . 0.0 109.292 171.976 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.83 -62.38 1.9 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.628 0.771 . . . . 0.0 109.912 173.427 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -165.71 168.88 15.75 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.458 0.646 . . . . 0.0 110.943 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.407 HG13 ' HB3' ' A' ' 20' ' ' TYR . 77.8 t -74.1 136.23 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.056 170.582 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.9 mt -103.0 -36.18 8.28 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.41 0.684 . . . . 0.0 110.201 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -156.12 162.74 40.2 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.27 -173.887 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -124.13 143.94 50.19 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.573 1.149 . . . . 0.0 109.344 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -137.78 164.76 28.11 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.728 0.811 . . . . 0.0 109.588 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.472 HG23 HG23 ' A' ' 18' ' ' VAL . 59.2 t -123.8 106.13 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 169.186 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.3 t -85.62 102.92 11.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 172.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 68.22 -76.08 0.06 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.257 1.423 . . . . 0.0 110.813 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.51 -10.29 0.82 Allowed Glycine 0 N--CA 1.477 1.409 0 C-N-CA 123.401 0.524 . . . . 0.0 112.833 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.53 ' HD2' ' HB3' ' A' ' 36' ' ' PRO . 18.7 ttpt -95.83 146.08 24.84 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.978 1.311 . . . . 0.0 109.319 -179.208 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.472 HG23 HG23 ' A' ' 13' ' ' VAL . 85.9 t -98.5 129.35 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.843 0.857 . . . . 0.0 109.822 177.587 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 33.9 mt-10 -121.07 148.05 44.69 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.842 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.407 ' HB3' HG13 ' A' ' 8' ' ' VAL . 88.5 m-85 -116.96 135.82 53.41 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.138 0.975 . . . . 0.0 109.551 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -78.64 106.78 10.86 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.467 HD22 HG21 ' A' ' 5' ' ' VAL . 27.0 mt -92.73 115.55 28.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.57 -173.352 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -76.73 108.94 10.11 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 166.112 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.552 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 81.4 m95 -75.17 123.44 25.26 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.444 0.465 . . . . 0.0 109.818 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -63.76 -48.34 77.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.946 0.898 . . . . 0.0 111.72 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.06 2.5 88.25 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.292 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.529 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 76.9 m-85 -128.69 171.18 12.44 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.965 0.906 . . . . 0.0 109.879 -176.509 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 82.2 p -80.55 166.12 21.46 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -174.288 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -68.64 -27.95 66.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.098 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.2 -16.66 64.07 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.585 0.754 . . . . 0.0 111.256 174.35 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.24 -1.29 21.94 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.739 0.815 . . . . 0.0 111.208 -175.407 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -58.81 126.33 27.2 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.328 0.651 . . . . 0.0 111.351 175.502 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.4 p -129.06 150.63 50.37 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.049 0.54 . . . . 0.0 111.377 -174.831 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -76.94 118.25 19.33 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.792 0.837 . . . . 0.0 109.978 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -119.8 135.78 24.43 Favored Pre-proline 0 N--CA 1.471 0.593 0 C-N-CA 122.645 0.378 . . . . 0.0 110.249 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.53 ' HB3' ' HD2' ' A' ' 17' ' ' LYS . 37.1 Cg_endo -64.71 159.57 44.61 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.7 2.267 . . . . 0.0 113.667 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -54.69 -37.2 65.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.114 1.366 . . . . 0.0 111.858 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -72.98 -22.14 60.74 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.836 1.254 . . . . 0.0 111.602 -177.379 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 50.2 t30 -90.79 -17.72 26.15 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 124.327 1.051 . . . . 0.0 110.825 -175.763 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.457 HD21 HD13 ' A' ' 22' ' ' LEU . 11.1 mt -76.84 129.88 36.85 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.117 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -104.82 17.67 23.7 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 170.047 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.419 ' SG ' ' HB3' ' A' ' 40' ' ' LEU . 10.8 p -116.71 90.03 30.28 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.601 1.16 . . . . 0.0 109.629 -175.728 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -80.71 -27.49 3.19 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 122.748 2.299 . . . . 0.0 112.857 -178.765 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -27.79 61.71 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.39 0.676 . . . . 0.0 110.366 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.468 HD23 ' HG2' ' B' ' 5' ' ' GLN . 34.5 mt -71.73 -40.01 69.72 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.268 0.355 . . . . 0.0 111.088 174.147 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.51 -43.61 98.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.87 -45.96 80.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.598 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.32 -31.8 73.12 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.144 -176.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -62.1 -47.87 82.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.638 0.775 . . . . 0.0 110.167 175.793 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.403 ' O ' ' HB2' ' A' ' 54' ' ' LYS . 98.7 mt -62.34 -45.95 90.88 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.3 179.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -68.15 -24.88 65.04 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.386 0.674 . . . . 0.0 111.327 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t -75.42 -63.09 1.36 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.072 0.549 . . . . 0.0 110.664 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 3.6 pp0? -90.75 8.87 32.42 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -171.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.403 ' HB2' ' O ' ' A' ' 50' ' ' LEU . 75.6 mmtt . . . . . 0 N--CA 1.483 1.202 0 C-N-CA 124.269 1.028 . . . . 0.0 108.606 171.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -80.81 -55.58 4.71 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.884 0.474 . . . . 0.0 110.223 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 20.8 p -71.12 96.79 1.4 Allowed 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.251 0.548 . . . . 0.0 109.557 176.822 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -112.67 89.32 3.04 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.513 0.725 . . . . 0.0 110.688 -177.643 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.518 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 0.8 OUTLIER -70.66 105.43 3.15 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.354 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 4.2 t -85.77 138.67 31.92 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.978 0.894 . . . . 0.0 112.577 -168.318 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -154.45 160.12 41.43 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 124.819 1.247 . . . . 0.0 108.166 170.192 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.458 ' HA ' ' HD2' ' A' ' 3' ' ' PHE . 0.1 OUTLIER -106.31 -174.21 2.48 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.092 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.813 0 C-N-CA 123.846 0.858 . . . . 0.0 109.012 174.302 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 71.1 p -67.69 88.39 0.24 Allowed 'General case' 0 CA--C 1.547 0.841 0 CA-C-O 121.748 0.785 . . . . 0.0 109.062 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 69.4 p -71.23 147.79 47.89 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.289 -175.357 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.21 -89.59 1.34 Allowed Glycine 0 C--N 1.34 0.78 0 N-CA-C 111.184 -0.767 . . . . 0.0 111.184 -177.347 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 58.83 -88.63 0.02 OUTLIER Glycine 0 C--N 1.353 1.49 0 O-C-N 124.195 0.585 . . . . 0.0 112.641 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -166.99 76.2 0.17 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.138 1.375 . . . . 0.0 107.535 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.006 0 C-N-CA 123.779 0.832 . . . . 0.0 109.932 -178.271 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.534 0 N-CA-C 112.113 -0.395 . . . . 0.0 112.113 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -149.48 -73.2 0.18 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.568 0.747 . . . . 0.0 110.659 -178.681 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -116.84 114.07 23.4 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.705 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.49 134.68 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-O 120.846 0.355 . . . . 0.0 110.063 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.416 HG23 HD21 ' A' ' 22' ' ' LEU . 2.3 p -116.09 132.9 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.935 0.894 . . . . 0.0 109.966 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -63.51 -57.73 9.27 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.388 1.075 . . . . 0.0 109.351 174.915 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -171.88 168.44 6.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.116 0.966 . . . . 0.0 111.031 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.427 HG12 ' HB3' ' A' ' 20' ' ' TYR . 58.5 t -79.11 144.23 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 123.591 0.756 . . . . 0.0 109.482 172.095 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.6 mt -108.45 -43.34 4.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.286 1.034 . . . . 0.0 111.097 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.65 164.75 35.32 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.171 0.589 . . . . 0.0 110.081 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -129.74 144.52 51.33 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.234 1.014 . . . . 0.0 110.145 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -141.41 167.26 22.59 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.393 1.077 . . . . 0.0 109.953 176.235 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.418 ' HA ' ' O ' ' A' ' 17' ' ' LYS . 49.1 t -126.4 108.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 168.618 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.27 126.46 61.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 66.55 -71.7 0.09 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.004 1.321 . . . . 0.0 111.123 -174.065 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.85 15.96 0.1 OUTLIER Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.914 176.297 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.418 ' O ' ' HA ' ' A' ' 13' ' ' VAL . 13.7 ptpt -118.33 159.42 23.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.694 0.797 . . . . 0.0 109.711 -179.625 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.8 t -101.29 118.84 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 123.237 0.615 . . . . 0.0 110.351 -179.25 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.728 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 38.8 mt-10 -104.88 161.25 14.35 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 121.604 0.716 . . . . 0.0 111.885 169.819 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.427 ' HB3' HG12 ' A' ' 8' ' ' VAL . 97.0 m-85 -135.69 128.17 30.51 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.036 1.334 . . . . 0.0 108.793 -177.678 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -77.67 107.24 10.02 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.416 HD21 HG23 ' A' ' 5' ' ' VAL . 18.6 mt -91.17 122.38 33.76 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 122.38 0.272 . . . . 0.0 111.217 -172.528 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -77.26 103.36 7.15 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 164.139 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.477 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 94.1 m95 -73.04 139.77 46.8 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 122.613 0.365 . . . . 0.0 110.497 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -90.57 120.14 31.41 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.556 0.742 . . . . 0.0 109.173 -175.77 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.28 -35.23 4.71 Favored Glycine 0 N--CA 1.472 1.1 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 -175.952 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.477 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 65.2 m-85 -80.74 162.31 24.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.108 0.963 . . . . 0.0 109.851 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.4 p -82.38 173.09 12.36 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.849 0.46 . . . . 0.0 110.923 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.21 -16.84 62.53 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.97 0.508 . . . . 0.0 111.686 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.86 -19.66 60.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.412 0.685 . . . . 0.0 111.107 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -88.16 -19.1 27.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.328 0.651 . . . . 0.0 111.54 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -52.76 121.72 7.76 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 123.718 0.636 . . . . 0.0 111.774 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.41 158.47 44.34 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.83 0.852 . . . . 0.0 110.996 -172.859 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.48 109.74 16.98 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.752 0.821 . . . . 0.0 110.63 -178.63 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.411 ' OE1' ' HA ' ' B' ' 9' ' ' M3L . 45.1 mm-40 -112.39 124.66 31.53 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.728 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 27.7 Cg_endo -63.18 161.94 28.39 Favored 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.772 2.315 . . . . 0.0 112.589 175.7 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -29.36 35.15 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.426 1.09 . . . . 0.0 112.42 178.672 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.464 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.5 pt-20 -67.2 -31.34 71.65 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.068 0.947 . . . . 0.0 111.044 178.796 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -80.31 -30.18 38.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.927 0.891 . . . . 0.0 111.114 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.409 HD22 HD11 ' A' ' 22' ' ' LEU . 13.5 mt -73.14 116.06 13.22 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.556 0.342 . . . . 0.0 110.325 -174.707 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -87.22 -7.57 57.77 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.5 ' HA ' ' HG2' ' B' ' 5' ' ' GLN . 12.7 p -92.81 98.81 2.44 Favored Pre-proline 0 C--N 1.354 0.777 0 C-N-CA 125.034 1.334 . . . . 0.0 110.8 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.36 -26.51 8.76 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.21 1.94 . . . . 0.0 111.546 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -77.88 -30.3 50.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.875 1.27 . . . . 0.0 111.606 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 59.5 mt -77.16 -27.4 53.75 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.522 0.329 . . . . 0.0 111.359 177.176 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.409 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 58.1 mt -68.2 -53.05 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 172.13 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.05 -51.89 68.09 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.406 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -42.26 91.22 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 124.041 0.838 . . . . 0.0 111.362 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.442 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 70.2 t80 -60.07 -48.37 82.01 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 0.0 110.942 175.984 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.409 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 72.9 mt -65.81 -25.9 67.44 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.35 0.66 . . . . 0.0 111.218 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -80.44 -27.18 38.02 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.567 0.747 . . . . 0.0 111.592 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.3 m -69.52 -51.71 33.16 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.457 0.646 . . . . 0.0 109.974 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.442 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 10.6 pt20 -79.66 -46.23 17.55 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.186 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt . . . . . 0 N--CA 1.482 1.144 0 C-N-CA 124.712 1.205 . . . . 0.0 111.062 -172.494 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -158.24 63.07 0.45 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.334 0.654 . . . . 0.0 110.265 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 27.3 m -79.25 69.96 5.55 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 122.055 0.931 . . . . 0.0 109.428 174.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -130.24 73.46 1.53 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -178.596 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.5 ' HG2' ' HA ' ' A' ' 42' ' ' CYS . 5.8 tp60 -115.32 162.22 17.41 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.065 -173.532 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.428 ' H ' ' HG3' ' B' ' 5' ' ' GLN . 11.5 t -100.7 177.22 5.06 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 122.333 1.063 . . . . 0.0 111.341 -176.684 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.24 163.89 39.08 Favored 'General case' 0 C--O 1.247 0.969 0 C-N-CA 125.566 1.546 . . . . 0.0 107.785 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -114.52 161.52 17.92 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.396 1.078 . . . . 0.0 108.47 -172.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.411 ' HA ' ' OE1' ' A' ' 35' ' ' GLU . . . . . . . . 0 N--CA 1.471 0.601 0 C-N-CA 123.024 0.53 . . . . 0.0 109.8 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 52.5 p -98.35 104.17 16.18 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.115 -0.366 . . . . 0.0 110.336 -172.417 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 10.0 t -67.3 -29.95 69.67 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.3 173.329 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -95.01 117.12 5.52 Favored Glycine 0 C--N 1.349 1.302 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 170.526 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -88.57 57.63 4.14 Favored Glycine 0 C--N 1.348 1.214 0 C-N-CA 123.096 0.379 . . . . 0.0 112.937 -174.646 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -149.18 116.97 6.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.498 0.719 . . . . 0.0 109.294 176.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.154 0 C-N-CA 123.829 0.851 . . . . 0.0 109.212 -177.964 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 CA-C-O 119.977 -0.346 . . . . 0.0 112.291 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -75.09 158.5 33.03 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.312 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -77.12 113.43 14.85 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -165.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.409 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 16.8 m -83.22 136.41 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 122.74 0.416 . . . . 0.0 110.1 -178.569 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.448 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -117.25 129.68 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.935 0.894 . . . . 0.0 110.185 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -70.37 -56.69 6.07 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 124.464 1.106 . . . . 0.0 110.616 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -155.07 161.16 41.38 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.735 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 61.7 t -88.29 136.14 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-N 115.323 -0.853 . . . . 0.0 108.802 168.859 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -102.8 -50.7 3.47 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 110.696 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -150.75 168.09 25.45 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.283 0.633 . . . . 0.0 110.316 -169.822 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -134.2 142.81 47.53 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.543 1.137 . . . . 0.0 111.36 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -134.71 168.88 18.21 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.143 1.377 . . . . 0.0 108.756 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.92 110.78 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.43 0.692 . . . . 0.0 109.347 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 64.3 t -106.47 107.44 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.381 1.072 . . . . 0.0 110.066 176.54 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 57.24 43.31 23.93 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.77 1.228 . . . . 0.0 112.291 170.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.39 -25.2 23.84 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 115.614 -0.721 . . . . 0.0 113.226 177.948 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -91.24 151.45 20.92 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.102 0.961 . . . . 0.0 109.727 179.037 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.8 t -98.03 138.31 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.65 0.78 . . . . 0.0 109.743 177.589 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.562 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.2 mt-10 -121.28 166.48 13.96 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 167.017 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -137.1 152.52 50.1 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.576 1.15 . . . . 0.0 108.836 -177.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -92.5 109.28 20.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.489 HD11 HD21 ' A' ' 40' ' ' LEU . 10.4 mp -92.05 116.52 29.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.109 0.564 . . . . 0.0 110.844 -174.072 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tmtm? -76.36 99.66 4.91 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 105.695 -1.965 . . . . 0.0 105.695 165.738 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.638 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 94.2 m95 -70.16 135.17 48.87 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.421 0.451 . . . . 0.0 111.42 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -78.39 121.04 23.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.533 1.133 . . . . 0.0 109.923 -176.413 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.78 0.0 87.81 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 113.312 -176.966 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.448 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.8 m-85 -118.6 152.45 36.01 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.993 0.917 . . . . 0.0 110.044 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.0 t -77.66 163.66 26.0 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.401 0.68 . . . . 0.0 111.746 -173.699 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.42 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 m-20 -65.44 -31.69 72.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.752 0.821 . . . . 0.0 111.992 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.41 -18.75 65.23 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.502 0.721 . . . . 0.0 111.79 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -108.56 -5.64 16.42 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.169 0.987 . . . . 0.0 111.177 -176.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.638 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.6 m120 -66.37 132.7 48.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.582 0.353 . . . . 0.0 111.102 175.35 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 62.6 p -127.35 160.98 29.73 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.46 0.704 . . . . 0.0 111.41 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -84.45 122.66 29.29 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.998 175.267 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -120.9 137.61 26.73 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 123.012 0.525 . . . . 0.0 110.61 175.642 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.562 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 32.2 Cg_endo -64.05 161.54 33.03 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 122.397 2.065 . . . . 0.0 112.084 173.743 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -24.32 66.33 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.8 179.591 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.438 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 17.1 pt-20 -73.98 -22.44 59.62 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.732 0.813 . . . . 0.0 111.441 178.653 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -87.42 -15.94 36.3 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.423 0.689 . . . . 0.0 111.372 177.089 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.489 HD21 HD11 ' A' ' 22' ' ' LEU . 62.5 mt -72.85 116.39 13.29 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.595 0.358 . . . . 0.0 111.2 -176.572 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 6.81 42.98 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 18.4 p -106.36 92.68 7.18 Favored Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 125.264 1.425 . . . . 0.0 110.147 -178.825 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -38.76 0.49 Allowed 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.605 2.203 . . . . 0.0 113.599 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.25 -21.21 59.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.815 0.446 . . . . 0.0 111.646 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.414 ' HG ' ' OE1' ' B' ' 5' ' ' GLN . 74.0 mt -73.25 -30.22 63.31 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.508 0.323 . . . . 0.0 111.275 174.758 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.4 mt -66.47 -46.53 86.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.615 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -62.86 -43.53 98.55 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.925 176.147 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.42 73.74 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.15 0.58 . . . . 0.0 110.915 -176.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -62.04 -43.57 98.56 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.059 0.944 . . . . 0.0 110.479 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.3 mt -71.18 -29.47 65.22 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.478 0.711 . . . . 0.0 110.291 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -76.55 -15.97 59.73 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.751 0.82 . . . . 0.0 111.189 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 29.7 m -82.9 -12.6 57.24 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.276 0.631 . . . . 0.0 110.393 172.799 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 70.5 mt-30 -93.13 -52.02 4.76 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.488 0.715 . . . . 0.0 109.541 176.963 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 mttm . . . . . 0 C--O 1.254 1.317 0 C-N-CA 125.071 1.349 . . . . 0.0 111.301 -176.833 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -106.81 3.54 26.54 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.558 0.743 . . . . 0.0 110.02 173.893 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 9.5 t -72.62 121.52 19.88 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.9 0.88 . . . . 0.0 111.139 -173.352 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -70.42 -36.37 73.97 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.058 0.943 . . . . 0.0 110.339 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.414 ' OE1' ' HG ' ' A' ' 45' ' ' LEU . 5.3 tp-100 59.59 84.77 0.11 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.922 1.289 . . . . 0.0 110.568 175.322 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.409 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 0.2 OUTLIER -128.04 176.66 7.45 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.456 -160.402 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -171.89 168.75 5.95 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.587 1.155 . . . . 0.0 109.473 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -111.29 148.25 33.31 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.145 0.978 . . . . 0.0 108.804 177.259 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.723 0 C-N-CA 122.904 0.482 . . . . 0.0 110.475 174.676 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.0 m -79.03 89.01 4.77 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 169.458 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 25.9 p -66.29 102.2 0.82 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.867 0.867 . . . . 0.0 110.738 -175.059 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 70.37 27.18 73.08 Favored Glycine 0 C--N 1.348 1.236 0 CA-C-N 115.273 -0.876 . . . . 0.0 112.777 -173.168 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 78.83 5.91 88.59 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-O 119.88 -0.4 . . . . 0.0 113.565 -175.199 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -122.87 150.57 42.71 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.511 0.724 . . . . 0.0 110.915 -177.094 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.974 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.053 175.85 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . 0.558 ' HA2' HG21 ' B' ' 6' ' ' THR . . . . . . . . 0 N--CA 1.478 1.498 0 N-CA-C 112.276 -0.33 . . . . 0.0 112.276 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.535 ' HG3' ' HG3' ' B' ' 8' ' ' ARG . 1.6 pm0 -111.72 -86.12 0.56 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.5 0.72 . . . . 0.0 109.479 -177.596 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . 0.534 ' H ' ' HG2' ' A' ' 2' ' ' GLU . 37.8 m-85 -102.5 118.8 37.64 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.286 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.492 ' HA ' HG23 ' B' ' 6' ' ' THR . 7.5 p -83.35 136.41 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.306 0.574 . . . . 0.0 111.579 -173.526 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.461 HG23 HD21 ' A' ' 22' ' ' LEU . 1.5 p -118.02 126.84 75.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.253 1.021 . . . . 0.0 109.445 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.25 -51.82 68.32 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.188 1.395 . . . . 0.0 111.514 174.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -170.77 165.54 7.98 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.73 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.428 HG12 ' HD2' ' A' ' 20' ' ' TYR . 98.0 t -82.26 133.59 28.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.596 168.206 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.9 mt -99.98 -38.47 8.58 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.468 0.707 . . . . 0.0 110.429 -178.394 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -153.62 163.6 39.7 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.85 0.46 . . . . 0.0 110.575 -174.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.0 ttt-85 -132.57 145.06 50.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.721 1.209 . . . . 0.0 109.329 -178.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -144.63 163.26 34.48 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.861 0.864 . . . . 0.0 109.655 176.15 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.464 HG23 HG22 ' A' ' 18' ' ' VAL . 88.3 t -122.23 109.49 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.612 0.765 . . . . 0.0 108.941 175.375 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.2 t -113.54 115.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.649 1.179 . . . . 0.0 109.701 177.788 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 64.73 27.71 13.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.839 1.256 . . . . 0.0 112.012 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.15 -11.82 66.24 Favored Glycine 0 N--CA 1.472 1.071 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.121 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -86.3 146.42 26.51 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.464 HG22 HG23 ' A' ' 13' ' ' VAL . 98.4 t -107.16 121.92 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.32 0.648 . . . . 0.0 109.453 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.502 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 48.5 mt-10 -112.84 155.91 23.82 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.048 0.939 . . . . 0.0 109.597 177.757 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.428 ' HD2' HG12 ' A' ' 8' ' ' VAL . 96.4 m-85 -132.92 129.45 38.34 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.469 1.108 . . . . 0.0 108.711 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -76.88 107.76 9.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.461 HD21 HG23 ' A' ' 5' ' ' VAL . 16.6 mt -87.51 122.73 31.61 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.9 -175.036 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -76.24 93.17 3.36 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 165.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.543 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 85.6 m95 -65.22 117.61 8.05 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.137 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -70.54 -43.46 69.49 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.308 0.643 . . . . 0.0 110.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.16 13.6 64.48 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.895 -0.593 . . . . 0.0 113.784 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -136.78 161.69 35.28 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.159 0.984 . . . . 0.0 109.801 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.3 p -68.24 159.74 30.62 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.756 0.822 . . . . 0.0 111.795 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.51 -38.27 89.19 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.055 -174.512 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.66 -19.86 65.96 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.341 0.657 . . . . 0.0 111.877 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -96.43 -2.11 46.11 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 123.933 0.893 . . . . 0.0 110.868 -178.733 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.543 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 1.5 m120 -64.94 129.08 38.42 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.631 0.773 . . . . 0.0 110.394 172.5 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 p -138.64 158.72 43.72 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.305 0.642 . . . . 0.0 112.01 -169.564 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -80.79 121.07 25.47 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.636 1.174 . . . . 0.0 111.147 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.453 ' HB2' HD22 ' A' ' 40' ' ' LEU . 49.3 mm-40 -122.59 134.01 24.72 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 123.425 0.69 . . . . 0.0 110.552 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.502 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 69.7 Cg_endo -70.6 154.86 64.15 Favored 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.778 2.319 . . . . 0.0 111.813 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.29 -28.39 62.98 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.407 1.083 . . . . 0.0 113.31 -175.327 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.92 -37.71 82.0 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.066 0.946 . . . . 0.0 110.552 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 41.8 t30 -77.58 -23.21 50.02 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 110.604 -178.027 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.453 HD22 ' HB2' ' A' ' 35' ' ' GLU . 57.6 mt -75.02 137.41 41.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.939 -178.456 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -111.68 11.26 21.06 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.909 0.883 . . . . 0.0 109.643 176.784 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.2 p -115.54 90.96 27.52 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 123.813 0.845 . . . . 0.0 111.059 -175.292 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.31 -24.72 14.1 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.615 2.21 . . . . 0.0 111.897 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.84 -52.74 63.9 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.779 1.232 . . . . 0.0 110.926 176.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.16 -33.68 73.78 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.144 -175.477 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 47.7 mm -68.4 -46.68 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 122.759 0.424 . . . . 0.0 110.391 178.422 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.9 -53.96 52.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.825 0.85 . . . . 0.0 110.522 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.57 -46.69 88.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.835 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -61.99 -52.41 64.11 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.067 0.947 . . . . 0.0 111.93 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.436 HD22 ' NE2' ' A' ' 53' ' ' GLN . 96.7 mt -61.15 -33.6 73.66 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.435 0.694 . . . . 0.0 111.181 -177.634 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -75.38 -37.77 60.35 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.428 0.691 . . . . 0.0 111.491 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 61.8 m -70.22 -15.39 62.92 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.752 0.821 . . . . 0.0 112.234 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.436 ' NE2' HD22 ' A' ' 50' ' ' LEU . 78.1 mt-30 -67.14 -28.22 67.95 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.073 0.549 . . . . 0.0 111.292 174.473 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.2 mtmm . . . . . 0 C--O 1.249 1.06 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 174.713 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.877 0.37 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 69.2 mtm180 -79.11 83.4 5.19 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.675 179.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 22.1 p -109.13 119.02 38.27 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.141 0.976 . . . . 0.0 109.564 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt -83.88 71.07 10.5 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.743 0.817 . . . . 0.0 109.591 178.066 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -100.5 84.64 2.8 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 122.068 0.937 . . . . 0.0 110.43 -174.747 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.558 HG21 ' HA2' ' A' ' 1' ' ' GLY . 40.8 p -134.01 175.18 9.71 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.817 1.247 . . . . 0.0 110.135 -177.633 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.21 161.37 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.633 1.173 . . . . 0.0 109.964 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.535 ' HG3' ' HG3' ' A' ' 2' ' ' GLU . 0.1 OUTLIER -90.99 -164.95 1.25 Allowed 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 174.351 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.033 0 O-C-N 121.669 -0.644 . . . . 0.0 111.959 178.543 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 23.5 t 72.06 -63.01 0.44 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.603 1.961 . . . . 0.0 110.854 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 62.5 p -75.96 78.41 2.84 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 125.201 1.4 . . . . 0.0 110.741 176.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.61 -34.67 48.79 Favored Glycine 0 C--N 1.343 0.938 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.76 173.275 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -136.43 -170.06 11.89 Favored Glycine 0 C--N 1.347 1.188 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 172.398 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -142.0 132.5 25.27 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.513 0.725 . . . . 0.0 109.777 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 C-N-CA 124.284 1.034 . . . . 0.0 108.338 176.668 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.922 0 N-CA-C 112.585 -0.206 . . . . 0.0 112.585 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.431 ' HG3' ' HD3' ' B' ' 8' ' ' ARG . 3.8 mp0 -90.18 131.53 35.97 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 177.146 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -124.54 156.31 37.57 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.124 0.569 . . . . 0.0 109.669 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.635 HG23 ' HB2' ' B' ' 4' ' ' LYS . 4.2 p -69.72 126.92 30.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 CA-C-O 121.353 0.597 . . . . 0.0 112.284 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.451 HG21 HD22 ' A' ' 22' ' ' LEU . 2.1 p -99.84 120.14 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.483 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.474 ' HG2' ' HZ2' ' A' ' 7' ' ' LYS . 35.5 tt0 -53.27 -57.96 8.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.733 1.613 . . . . 0.0 111.726 174.054 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.474 ' HZ2' ' HG2' ' A' ' 6' ' ' GLU . 8.1 ptpp? -162.52 161.88 27.16 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.52 -174.902 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.5 t -85.49 130.65 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 168.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.7 mt -96.91 -38.54 9.78 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.887 0.875 . . . . 0.0 111.282 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -156.24 164.33 38.48 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.117 -169.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.513 ' HE ' HG13 ' A' ' 18' ' ' VAL . 41.8 ttt180 -134.94 144.33 47.39 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 0.0 110.577 -173.375 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -140.49 163.62 32.34 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.791 0.836 . . . . 0.0 109.798 176.617 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . 0.42 HG22 HG23 ' A' ' 18' ' ' VAL . 89.2 t -121.7 123.93 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.019 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . 0.434 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 2.6 p -139.21 123.25 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.032 0.933 . . . . 0.0 108.884 -177.863 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 60.77 22.49 12.48 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.276 1.03 . . . . 0.0 112.455 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.31 -8.15 77.61 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.878 -0.401 . . . . 0.0 113.994 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . 0.434 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 15.0 ptpt -94.93 171.58 8.68 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.513 HG13 ' HE ' ' A' ' 11' ' ' ARG . 99.1 t -117.69 126.3 74.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 174.89 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.557 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 36.7 mt-10 -106.82 157.09 18.01 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.576 0.703 . . . . 0.0 109.721 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -126.61 127.44 45.23 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.441 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -77.06 108.85 10.43 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.451 HD22 HG21 ' A' ' 5' ' ' VAL . 49.8 mt -81.78 172.79 12.95 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.061 0.851 . . . . 0.0 111.102 -174.648 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -126.46 100.97 6.48 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.514 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 84.6 m95 -69.57 116.63 10.19 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.754 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -73.1 114.32 11.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 123.778 0.674 . . . . 0.0 110.173 -171.599 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 118.13 -29.26 6.56 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 -174.17 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -98.05 157.81 15.91 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.214 1.005 . . . . 0.0 111.256 179.084 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 9.1 t -74.26 160.77 30.66 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.598 178.714 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.471 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.7 m-20 -70.0 -19.04 63.35 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.147 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.02 -31.54 66.29 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.868 0.867 . . . . 0.0 110.578 173.308 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.7 t70 -78.79 -30.7 45.65 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.366 0.666 . . . . 0.0 110.978 -178.95 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.514 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.0 m120 -61.46 148.75 40.83 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.846 0.716 . . . . 0.0 112.423 -172.746 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.3 p -126.57 163.8 22.61 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.772 0.829 . . . . 0.0 111.286 -167.779 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.3 119.73 25.41 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 170.632 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -119.56 132.71 23.92 Favored Pre-proline 0 C--O 1.239 0.511 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 172.125 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.557 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 48.2 Cg_endo -67.11 160.0 49.46 Favored 'Trans proline' 0 C--N 1.366 1.455 0 C-N-CA 122.161 1.907 . . . . 0.0 112.333 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -55.69 -28.22 54.38 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.025 1.33 . . . . 0.0 112.204 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.467 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.0 pt-20 -75.5 -17.72 60.03 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.056 1.342 . . . . 0.0 111.731 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -107.97 -4.77 17.57 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.199 0.599 . . . . 0.0 111.331 -169.636 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.551 HD12 HD13 ' A' ' 46' ' ' ILE . 30.7 mt -87.05 158.2 19.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.15 0.58 . . . . 0.0 110.861 -177.49 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.54 9.76 25.23 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 166.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 23.0 p -117.43 90.61 35.28 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 123.069 0.548 . . . . 0.0 111.527 -172.663 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.75 -22.14 10.63 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.314 2.01 . . . . 0.0 111.079 166.319 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.28 -44.31 83.91 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.246 1.018 . . . . 0.0 111.593 177.556 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.81 -29.18 55.87 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.982 0.513 . . . . 0.0 110.963 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.551 HD13 HD12 ' A' ' 40' ' ' LEU . 72.0 mt -63.48 -54.28 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 172.088 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.51 -46.14 89.78 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.692 -176.843 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.2 90.2 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 123.747 0.655 . . . . 0.0 110.766 -177.974 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.442 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 82.8 t80 -58.78 -48.5 81.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.044 0.538 . . . . 0.0 109.952 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.3 mt -65.56 -27.6 68.55 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.498 0.719 . . . . 0.0 111.557 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -82.5 -19.64 38.35 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.582 0.753 . . . . 0.0 111.981 175.412 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.5 m -83.07 -55.06 4.59 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.691 0.396 . . . . 0.0 110.321 177.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.442 ' HG3' ' O ' ' A' ' 49' ' ' PHE . 1.3 pp0? -78.15 -24.1 47.44 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.68 0.392 . . . . 0.0 111.806 -179.407 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.1 mtmm . . . . . 0 N--CA 1.484 1.272 0 C-N-CA 124.599 1.16 . . . . 0.0 111.817 175.235 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 121.043 0.449 . . . . 0.0 109.951 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -139.45 109.35 6.35 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.562 0.745 . . . . 0.0 109.466 177.598 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 12.2 p -113.44 135.82 53.45 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 123.574 0.749 . . . . 0.0 109.967 176.307 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . 0.635 ' HB2' HG23 ' A' ' 4' ' ' VAL . 21.4 pttm -103.62 80.67 1.81 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 122.031 0.919 . . . . 0.0 108.612 174.674 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -78.99 145.36 33.97 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.789 -175.189 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.544 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 76.1 p -99.33 177.71 5.11 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.016 0.912 . . . . 0.0 112.532 -171.828 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -163.84 156.36 17.64 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.267 174.177 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.431 ' HD3' ' HG3' ' A' ' 2' ' ' GLU . 14.1 tpt180 -97.41 146.15 25.48 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.249 0.62 . . . . 0.0 109.673 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.513 0 C-N-CA 123.153 0.581 . . . . 0.0 109.858 169.738 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 36.9 t -56.0 93.31 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.957 0.903 . . . . 0.0 110.904 -178.066 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 2.9 t -74.17 84.5 1.85 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.498 1.119 . . . . 0.0 111.005 -173.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 70.02 -86.03 0.3 Allowed Glycine 0 C--N 1.345 1.054 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.727 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 77.06 -67.02 2.78 Favored Glycine 0 C--N 1.354 1.528 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 -171.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -158.06 93.36 1.24 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.703 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 C-N-CA 123.842 0.857 . . . . 0.0 109.465 -172.914 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.469 0 N-CA-C 111.799 -0.521 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -90.25 94.34 9.72 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.332 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -93.98 157.73 15.96 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.871 -177.798 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.4 p -80.53 123.82 37.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-O 121.468 0.651 . . . . 0.0 109.562 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.505 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -102.97 133.45 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.412 1.085 . . . . 0.0 109.358 175.547 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.613 ' HB2' ' HG3' ' A' ' 25' ' ' LYS . 34.3 tt0 -69.55 -49.15 57.02 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.474 0.71 . . . . 0.0 111.01 176.585 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . 0.43 ' HA ' HD23 ' A' ' 45' ' ' LEU . 21.1 ptmt -166.61 164.92 16.93 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.633 0.583 . . . . 0.0 111.607 -173.937 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.439 HG13 ' HD2' ' A' ' 20' ' ' TYR . 94.7 t -85.51 135.76 24.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.475 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.0 mt -100.48 -43.64 6.15 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.736 0.814 . . . . 0.0 110.137 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -148.92 164.86 33.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.343 -171.076 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . 0.462 ' HE ' HG13 ' A' ' 18' ' ' VAL . 34.9 ttt180 -138.72 128.59 25.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.068 0.947 . . . . 0.0 109.485 -175.878 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 3.0 ptm180 -124.41 162.31 24.15 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.934 0.894 . . . . 0.0 109.35 175.987 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -126.31 112.45 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.966 0.906 . . . . 0.0 108.768 177.63 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.0 m -120.45 125.2 73.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.113 0.965 . . . . 0.0 109.401 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 61.61 20.84 11.63 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.226 1.01 . . . . 0.0 112.108 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.8 -24.04 32.76 Favored Glycine 0 C--N 1.348 1.211 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.448 -176.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.8 ptmt -82.54 163.35 21.58 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . 0.462 HG13 ' HE ' ' A' ' 11' ' ' ARG . 45.9 t -117.6 127.11 75.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 123.312 0.645 . . . . 0.0 110.186 -176.382 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.551 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 45.1 mt-10 -109.19 154.05 22.92 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.599 0.76 . . . . 0.0 109.586 170.504 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HD2' HG13 ' A' ' 8' ' ' VAL . 63.8 m-85 -128.04 128.51 45.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.435 1.094 . . . . 0.0 108.669 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -78.51 107.89 11.49 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.2 mt -92.84 119.86 32.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.345 -171.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -75.87 93.33 3.18 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 167.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.604 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 87.1 m95 -68.51 134.79 50.6 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 178.483 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.613 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 26.4 mttm -67.64 134.23 50.79 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.863 0.727 . . . . 0.0 110.19 172.537 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.19 -33.95 4.12 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.842 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.42 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 79.7 m-85 -91.43 149.48 21.69 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.048 0.939 . . . . 0.0 110.509 -177.146 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 p -70.54 160.98 31.47 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.934 0.894 . . . . 0.0 111.795 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . 0.468 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 p-10 -65.54 -29.94 70.62 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.341 1.057 . . . . 0.0 111.872 -177.406 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.8 -27.02 57.78 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.541 0.736 . . . . 0.0 111.19 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -89.04 -11.96 42.67 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.65 0.78 . . . . 0.0 110.83 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.604 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -64.26 143.07 58.16 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 122.529 0.332 . . . . 0.0 110.479 174.668 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 34.2 p -132.94 160.85 35.87 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.191 0.596 . . . . 0.0 111.876 -168.427 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -82.24 122.23 27.65 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.78 173.873 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -121.08 130.18 24.96 Favored Pre-proline 0 C--O 1.239 0.533 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 171.989 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.551 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 23.6 Cg_endo -61.22 162.04 21.19 Favored 'Trans proline' 0 C--N 1.371 1.758 0 C-N-CA 122.339 2.026 . . . . 0.0 112.31 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -55.02 -26.32 36.42 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 125.555 1.542 . . . . 0.0 113.153 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -77.65 -28.22 51.2 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.825 1.25 . . . . 0.0 111.989 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.6 m-20 -77.63 -21.87 51.62 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.525 0.73 . . . . 0.0 111.517 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.0 mt -73.28 117.48 15.07 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 122.886 0.474 . . . . 0.0 110.412 -176.624 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -94.78 -3.84 48.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.391 0.676 . . . . 0.0 110.204 172.382 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 16.3 p -101.01 98.0 7.91 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.618 1.167 . . . . 0.0 110.893 -176.08 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -76.22 -25.19 10.27 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.623 2.215 . . . . 0.0 112.191 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -59.3 -47.99 83.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.549 1.14 . . . . 0.0 110.916 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.43 HD23 ' HA ' ' A' ' 7' ' ' LYS . 91.7 mt -70.36 -34.49 72.67 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.656 -177.084 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.6 mt -66.0 -51.01 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.88 -51.41 69.81 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.932 0.893 . . . . 0.0 111.025 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.93 79.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.565 0.746 . . . . 0.0 112.23 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -71.77 -54.44 10.22 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 122.722 0.409 . . . . 0.0 110.489 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.94 -37.68 79.01 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.516 0.726 . . . . 0.0 112.208 -171.112 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -81.55 -16.77 50.67 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.682 0.393 . . . . 0.0 111.564 -177.238 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 t -76.26 -15.71 59.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 122.528 0.331 . . . . 0.0 110.824 175.723 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -74.72 -52.63 11.04 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 123.595 0.758 . . . . 0.0 110.166 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.7 pttt . . . . . 0 CA--C 1.561 1.39 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.708 179.449 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -116.56 -12.2 10.99 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.367 1.067 . . . . 0.0 110.764 173.843 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 15.0 p -56.7 123.6 15.51 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 123.615 0.766 . . . . 0.0 110.718 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -62.58 111.82 2.22 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 177.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -80.9 74.71 7.87 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.782 0.801 . . . . 0.0 109.187 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.6 m -104.44 153.47 21.07 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 113.885 -1.507 . . . . 0.0 108.971 -176.649 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.09 140.24 17.5 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.383 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 15.1 ttt85 -82.27 137.64 34.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.637 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.683 0 O-C-N 122.083 -0.386 . . . . 0.0 110.299 170.232 . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 67.3 m -70.82 -12.79 61.76 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.423 0.689 . . . . 0.0 111.276 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 4.4 t -145.92 94.55 2.5 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 122.078 0.942 . . . . 0.0 110.023 175.367 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.07 56.56 1.53 Allowed Glycine 0 C--N 1.342 0.908 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 168.369 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 97.62 -170.76 25.72 Favored Glycine 0 C--N 1.345 1.046 0 CA-C-N 114.69 -0.755 . . . . 0.0 111.302 -167.298 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -141.97 155.55 45.46 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.449 0.7 . . . . 0.0 110.115 -178.225 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.08 0.952 . . . . 0.0 109.995 -176.092 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.65 0 N-CA-C 112.718 -0.153 . . . . 0.0 112.718 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . 0.409 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 32.8 tt0 -89.73 122.97 33.33 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 173.924 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -135.26 156.83 48.32 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.099 0.96 . . . . 0.0 109.322 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.426 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 3.7 p -69.61 109.84 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.96 0.886 . . . . 0.0 111.193 176.226 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.455 HG23 HD22 ' A' ' 22' ' ' LEU . 1.7 p -76.85 140.5 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.223 171.082 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.555 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 35.1 tt0 -68.31 -59.51 3.14 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.408 0.683 . . . . 0.0 110.162 176.356 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -166.41 164.87 17.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.598 -176.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.426 HG21 ' HB3' ' A' ' 45' ' ' LEU . 91.6 t -83.72 137.3 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.089 0.955 . . . . 0.0 108.969 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.5 mt -110.01 -29.58 8.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.354 0.661 . . . . 0.0 110.805 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -160.31 165.33 31.5 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.691 0.396 . . . . 0.0 110.65 -173.306 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.2 ttt180 -139.01 134.86 33.61 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.109 1.364 . . . . 0.0 109.754 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -134.04 175.69 9.25 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.534 1.134 . . . . 0.0 109.493 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -125.23 114.67 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.594 0.758 . . . . 0.0 109.654 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 73.3 t -126.85 131.76 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 173.558 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 70.63 14.52 7.2 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.714 1.259 . . . . 0.0 110.924 -177.315 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.0 9.29 86.84 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 116.184 -0.462 . . . . 0.0 113.074 -173.688 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.25 155.54 23.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 56.2 t -96.4 119.98 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.72 0.808 . . . . 0.0 109.632 -171.284 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.655 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.6 mt-10 -119.56 138.5 53.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.417 0.687 . . . . 0.0 110.017 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -113.93 132.33 55.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.1 0.96 . . . . 0.0 110.25 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -78.12 107.82 10.97 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.455 HD22 HG23 ' A' ' 5' ' ' VAL . 39.9 mt -97.74 122.41 40.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.352 -171.249 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.5 tmtt? -79.89 113.69 18.24 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 161.169 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.531 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.7 m95 -82.75 139.02 33.84 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.119 0.568 . . . . 0.0 110.005 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.555 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 59.2 tttp -62.67 -59.2 5.23 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.563 0.745 . . . . 0.0 112.009 -166.76 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.29 29.07 6.28 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 113.649 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.531 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 88.7 m-85 -135.69 167.37 21.27 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.407 1.083 . . . . 0.0 109.836 174.925 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.4 p -82.8 171.81 13.54 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.509 0.724 . . . . 0.0 111.869 -175.507 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -70.26 -30.23 67.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.604 0.762 . . . . 0.0 110.98 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.85 60.64 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.546 0.738 . . . . 0.0 111.101 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . 0.407 ' OD2' HM22 ' B' ' 9' ' ' M3L . 10.9 t70 -94.59 10.89 33.02 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.396 -177.539 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.8 142.83 57.22 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.095 0.958 . . . . 0.0 111.662 174.848 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.9 p -141.33 155.61 45.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.609 0.764 . . . . 0.0 110.976 -176.031 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -87.29 111.26 20.87 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.787 0.835 . . . . 0.0 110.912 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -117.73 126.96 26.95 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.655 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.9 Cg_endo -67.01 157.22 62.8 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 122.497 2.131 . . . . 0.0 112.886 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -30.63 61.71 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.575 1.15 . . . . 0.0 112.885 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -67.43 -33.89 76.09 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.642 0.734 . . . . 0.0 110.346 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 60.1 t30 -89.5 -18.92 25.75 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.854 1.262 . . . . 0.0 110.833 -175.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.523 HD13 HD13 ' A' ' 46' ' ' ILE . 23.3 mt -70.51 162.73 28.26 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.784 0.434 . . . . 0.0 110.655 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -137.07 34.21 2.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 24.4 p -147.76 95.01 4.29 Favored Pre-proline 0 C--N 1.355 0.818 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.497 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.86 -16.11 18.54 Favored 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.234 1.956 . . . . 0.0 111.323 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -60.5 -43.8 96.65 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.457 1.103 . . . . 0.0 111.218 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . 0.456 HD23 ' HG3' ' B' ' 5' ' ' GLN . 69.6 mt -72.95 -44.59 60.97 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.865 0.466 . . . . 0.0 111.787 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.523 HD13 HD13 ' A' ' 40' ' ' LEU . 63.4 mt -60.94 -45.16 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 123.819 0.699 . . . . 0.0 110.536 -176.783 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.51 -52.99 58.85 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.339 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.32 -32.5 66.77 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.696 0.798 . . . . 0.0 112.216 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -67.29 -42.95 82.91 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.647 1.179 . . . . 0.0 110.684 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 90.2 mt -75.84 -32.34 59.74 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.162 0.585 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.42 -26.68 60.22 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.277 1.031 . . . . 0.0 110.271 -179.192 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t -65.08 -33.21 75.49 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.842 0.857 . . . . 0.0 110.293 173.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -75.66 -29.22 59.02 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.985 0.914 . . . . 0.0 111.245 -177.896 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? . . . . . 0 C--O 1.251 1.178 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.444 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.21 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 41.3 mmt180 64.62 15.45 9.7 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 125.156 1.382 . . . . 0.0 112.868 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 17.0 m 55.88 75.95 0.31 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.617 1.167 . . . . 0.0 110.722 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -109.16 89.76 3.09 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.345 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.456 ' HG3' HD23 ' A' ' 45' ' ' LEU . 16.5 pm0 -110.54 104.43 13.15 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-O 121.901 0.858 . . . . 0.0 109.373 -172.911 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 6' ' ' THR . . . . . 0.426 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 14.8 p -113.29 169.39 8.98 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.173 0.989 . . . . 0.0 111.133 -175.988 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.47 159.28 19.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 123.79 0.836 . . . . 0.0 109.176 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . 0.409 ' HA ' ' HA ' ' A' ' 2' ' ' GLU . 32.8 ttm-85 -111.33 163.14 14.29 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -175.95 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.407 HM22 ' OD2' ' A' ' 31' ' ' ASP . . . . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 179.166 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 39.6 p -173.82 118.62 0.27 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.875 0.87 . . . . 0.0 109.172 175.778 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 35.8 m -55.42 -48.98 73.57 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.028 0.931 . . . . 0.0 110.452 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.78 77.21 2.14 Favored Glycine 0 CA--C 1.53 0.969 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 167.424 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.92 77.24 1.14 Allowed Glycine 0 C--N 1.355 1.619 0 C-N-CA 123.891 0.757 . . . . 0.0 112.463 -176.092 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -153.17 151.59 30.3 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.384 1.074 . . . . 0.0 109.717 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.215 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 178.917 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.647 0 N-CA-C 111.961 -0.456 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -73.94 -49.01 26.61 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.717 0.259 . . . . 0.0 111.64 -175.581 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -119.49 115.32 23.81 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.412 0.625 . . . . 0.0 109.377 175.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . 0.408 HG13 ' HB3' ' A' ' 25' ' ' LYS . 4.2 p -83.81 135.91 23.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.607 177.248 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . 0.506 HG22 ' HG ' ' A' ' 22' ' ' LEU . 1.5 p -112.99 130.7 66.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.77 -63.87 1.01 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.252 1.021 . . . . 0.0 110.171 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -165.05 169.68 16.0 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.767 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.527 HG11 ' HD2' ' A' ' 20' ' ' TYR . 99.8 t -83.08 144.64 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.815 171.631 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.44 -31.63 7.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.754 0.822 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -154.23 161.84 41.56 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -176.047 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.9 ttt180 -133.76 141.37 47.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.471 0.708 . . . . 0.0 109.223 -179.893 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -148.25 171.43 15.97 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.955 0.502 . . . . 0.0 110.4 178.33 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -119.79 120.82 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 123.76 0.824 . . . . 0.0 109.216 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.1 t -131.62 126.49 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.21 1.004 . . . . 0.0 108.703 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.5 m120 67.23 18.06 10.31 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.938 1.295 . . . . 0.0 111.267 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.56 -18.05 48.66 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.561 -172.881 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -78.26 162.71 26.34 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.622 0.769 . . . . 0.0 110.128 -177.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 82.4 t -107.81 106.93 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 0.0 109.391 -175.413 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.593 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 89.8 mt-10 -105.14 152.86 22.29 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.327 0.651 . . . . 0.0 111.225 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.527 ' HD2' HG11 ' A' ' 8' ' ' VAL . 92.3 m-85 -132.53 136.5 46.67 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.074 1.35 . . . . 0.0 107.777 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -79.59 105.77 11.14 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 174.434 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.506 ' HG ' HG22 ' A' ' 5' ' ' VAL . 10.2 mp -86.88 113.53 22.75 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.398 0.679 . . . . 0.0 110.777 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtm? -72.84 97.65 2.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 168.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.557 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 83.6 m95 -65.1 123.43 19.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 174.808 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.408 ' HB3' HG13 ' A' ' 4' ' ' VAL . 85.0 tttt -64.95 115.49 5.43 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.398 1.061 . . . . 0.0 110.612 -172.905 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.08 -4.05 67.39 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 115.667 -0.697 . . . . 0.0 113.475 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.414 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 96.4 m-85 -109.7 142.25 41.15 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.964 0.905 . . . . 0.0 110.073 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 t -62.37 152.45 34.0 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.775 0.83 . . . . 0.0 111.643 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.84 -23.28 64.23 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.903 0.881 . . . . 0.0 112.747 -172.341 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.82 -31.16 64.6 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.902 0.481 . . . . 0.0 110.634 173.097 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -80.08 -30.2 39.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.706 0.802 . . . . 0.0 111.196 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.557 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -61.46 143.36 56.02 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.215 0.606 . . . . 0.0 111.195 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.9 p -126.97 169.28 13.48 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.206 0.602 . . . . 0.0 112.268 -164.093 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -88.25 114.66 25.09 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.743 0.817 . . . . 0.0 109.854 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.464 ' HB2' HD12 ' A' ' 22' ' ' LEU . 72.8 mm-40 -117.98 131.45 24.15 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 123.441 0.696 . . . . 0.0 109.766 173.759 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.593 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 67.8 Cg_endo -72.09 153.93 57.38 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 122.188 1.925 . . . . 0.0 112.18 174.489 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -30.68 63.37 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.192 0.997 . . . . 0.0 112.178 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.51 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 16.2 pt-20 -70.8 -8.81 55.17 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.397 1.079 . . . . 0.0 111.477 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -115.6 -7.28 12.19 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.159 0.983 . . . . 0.0 110.72 -174.942 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.417 HD22 HD23 ' A' ' 22' ' ' LEU . 14.1 mt -86.73 143.09 27.71 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.036 0.534 . . . . 0.0 112.04 -175.837 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -93.12 -6.45 47.97 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.048 0.539 . . . . 0.0 110.305 172.013 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . 0.524 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 21.2 p -107.15 98.47 22.4 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -175.908 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.9 -27.35 8.69 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.339 2.026 . . . . 0.0 111.666 173.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -61.21 -47.12 87.6 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 123.766 0.827 . . . . 0.0 111.154 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.13 -29.65 65.51 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.26 0.624 . . . . 0.0 111.762 -175.5 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.6 mt -66.19 -54.12 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.566 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -54.56 -53.51 53.52 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.326 1.05 . . . . 0.0 109.671 176.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -33.09 74.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.792 -168.106 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -65.86 -50.38 64.78 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.437 0.461 . . . . 0.0 110.246 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.446 ' HA ' HE21 ' A' ' 53' ' ' GLN . 72.6 mt -62.92 -32.13 73.35 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.841 0.713 . . . . 0.0 110.247 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -71.31 -39.33 71.51 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.825 1.25 . . . . 0.0 109.463 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.8 t -70.65 -27.73 64.27 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.299 -177.743 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.446 HE21 ' HA ' ' A' ' 50' ' ' LEU . 35.6 mt-30 -61.35 -29.3 69.81 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.712 0.405 . . . . 0.0 110.182 175.291 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . 0.716 ' HZ3' ' HA ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.144 0 C-N-CA 123.173 0.589 . . . . 0.0 109.737 174.376 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -112.59 -65.71 1.15 Allowed 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 27.2 p -104.34 157.34 17.21 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.35 1.06 . . . . 0.0 109.848 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -88.66 102.85 15.38 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.744 0.818 . . . . 0.0 110.631 -177.921 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . 0.524 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 2.2 mp0 -77.5 80.46 3.99 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.822 0.849 . . . . 0.0 110.985 177.685 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 35.4 p -142.67 176.31 9.14 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 124.041 0.937 . . . . 0.0 109.338 178.885 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -166.26 174.4 9.2 Favored 'General case' 0 C--O 1.261 1.686 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.112 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -128.26 131.89 48.74 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.582 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 -176.72 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 25.6 t -68.11 94.33 0.49 Allowed 'General case' 0 C--O 1.241 0.621 0 O-C-N 124.052 0.845 . . . . 0.0 109.533 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 13.2 t -70.71 -17.75 62.82 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.597 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 113.77 160.44 13.75 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 -176.6 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 78.7 25.51 60.43 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 -177.315 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -87.12 89.79 8.12 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.861 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.556 1.189 0 C-N-CA 123.85 0.86 . . . . 0.0 109.152 177.096 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.54 0 N-CA-C 112.135 -0.386 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -77.76 148.06 35.02 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.525 0.73 . . . . 0.0 109.408 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -89.0 116.2 27.12 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.7 p -74.64 125.47 34.11 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.397 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.3 p -107.19 134.92 47.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.642 -177.025 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' GLU . . . . . 0.4 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 8.2 tp10 -66.95 -58.15 5.52 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.543 1.137 . . . . 0.0 110.547 177.841 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -164.17 167.24 20.34 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.883 -170.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' VAL . . . . . 0.459 HG13 ' HB3' ' A' ' 20' ' ' TYR . 65.2 t -94.18 141.5 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 169.008 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.4 mt -109.44 -38.39 5.48 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.076 0.95 . . . . 0.0 111.075 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -157.85 164.39 37.0 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.921 0.489 . . . . 0.0 110.218 -172.597 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -130.88 138.83 49.99 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.657 1.183 . . . . 0.0 110.045 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -132.88 163.04 30.01 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.281 1.032 . . . . 0.0 109.102 174.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.0 t -130.87 109.07 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 171.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 m -118.78 125.2 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.192 0.997 . . . . 0.0 110.6 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 58.51 25.99 13.75 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.658 1.183 . . . . 0.0 112.281 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.02 -16.87 58.53 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.286 -178.269 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.3 ttpp -84.04 149.64 26.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.048 0.939 . . . . 0.0 109.42 178.042 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.8 t -115.98 114.44 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.82 0.848 . . . . 0.0 109.307 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' GLU . . . . . 0.654 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 40.4 mt-10 -110.43 155.23 22.49 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.154 0.502 . . . . 0.0 110.708 -179.284 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' TYR . . . . . 0.459 ' HB3' HG13 ' A' ' 8' ' ' VAL . 96.7 m-85 -128.36 130.23 47.42 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.246 1.018 . . . . 0.0 109.059 -177.924 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.67 107.39 11.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' LEU . . . . . 0.42 HD11 HD21 ' A' ' 40' ' ' LEU . 39.1 mt -95.87 129.48 43.11 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 122.843 0.457 . . . . 0.0 111.083 -171.898 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' LYS . . . . . 0.44 ' HG2' HD22 ' A' ' 32' ' ' ASN . 5.7 tmtm? -84.02 115.54 22.4 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 162.862 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' TRP . . . . . 0.527 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 82.1 m95 -79.71 130.37 35.29 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.725 0.41 . . . . 0.0 109.959 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LYS . . . . . 0.4 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 20.5 ttpp -67.76 -46.13 72.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.188 0.595 . . . . 0.0 111.792 -167.96 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.17 20.36 50.48 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.409 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.527 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 86.6 m-85 -140.0 171.27 14.43 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.761 0.824 . . . . 0.0 111.152 -176.935 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.1 p -80.47 172.02 14.3 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.961 0.904 . . . . 0.0 112.777 -174.691 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.67 -27.67 63.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.434 1.094 . . . . 0.0 111.445 176.355 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.05 -22.72 62.09 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.207 0.603 . . . . 0.0 110.953 175.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -85.34 -20.15 30.39 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.283 1.033 . . . . 0.0 110.927 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' ASN . . . . . 0.44 HD22 ' HG2' ' A' ' 23' ' ' LYS . 11.0 m-20 -48.87 121.69 4.95 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.364 1.066 . . . . 0.0 111.643 176.155 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.46 158.13 45.16 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.268 0.627 . . . . 0.0 112.003 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -81.4 113.09 19.25 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.568 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' GLU . . . . . 0.422 ' HB2' HD22 ' A' ' 40' ' ' LEU . 46.3 mm-40 -117.43 129.07 25.59 Favored Pre-proline 0 CA--C 1.544 0.714 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.323 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' PRO . . . . . 0.654 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.6 Cg_endo -66.57 159.0 52.86 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 122.526 2.151 . . . . 0.0 113.287 177.058 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' GLU . . . . . 0.426 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -63.19 -28.31 69.96 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.654 0.781 . . . . 0.0 112.323 -177.532 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' GLU . . . . . 0.517 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.0 pt-20 -68.36 -20.68 64.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.156 0.982 . . . . 0.0 111.27 175.186 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' ASN . . . . . 0.53 HD22 ' HA ' ' B' ' 9' ' ' M3L . 67.2 t30 -103.91 -7.17 20.64 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.618 1.167 . . . . 0.0 110.293 -175.056 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 35' ' ' GLU . 18.5 mt -89.51 137.31 32.44 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.206 0.602 . . . . 0.0 110.838 178.433 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -100.07 -3.01 32.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.39 0.676 . . . . 0.0 109.438 170.495 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.7 p -106.57 91.75 6.35 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.141 0.976 . . . . 0.0 110.618 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.31 -14.28 4.89 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.423 2.082 . . . . 0.0 112.501 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -70.44 -44.11 68.5 Favored 'General case' 0 C--O 1.215 -0.744 0 C-N-CA 123.825 0.85 . . . . 0.0 109.843 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.21 -33.59 76.37 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.509 0.724 . . . . 0.0 111.01 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ILE . . . . . 0.52 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 75.2 mt -64.41 -55.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 174.173 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.26 -45.49 80.06 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.091 0.956 . . . . 0.0 111.326 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.11 -42.39 99.17 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.237 1.015 . . . . 0.0 110.802 -177.476 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' PHE . . . . . 0.416 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 59.8 t80 -60.31 -50.48 73.46 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.694 174.577 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' LEU . . . . . 0.52 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 81.5 mt -62.06 -36.49 81.8 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.802 0.841 . . . . 0.0 111.255 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.32 -40.09 62.44 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 110.39 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.0 m -80.51 2.08 26.8 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.342 0.657 . . . . 0.0 112.563 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.416 ' HG3' ' O ' ' A' ' 49' ' ' PHE . 77.2 mt-30 -69.56 -54.42 14.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 170.52 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.9 mptt . . . . . 0 C--O 1.249 1.058 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.132 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.841 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -88.36 76.13 8.38 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 174.588 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 22.7 m -96.49 100.12 11.73 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.965 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -123.87 -21.61 5.09 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.618 0.767 . . . . 0.0 109.988 167.995 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -79.74 77.83 6.35 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.934 0.873 . . . . 0.0 110.148 -177.928 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 36.3 p -126.28 177.56 6.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.321 -1.308 . . . . 0.0 109.861 -177.039 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.93 171.83 16.17 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.134 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -128.2 171.49 11.9 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 -174.015 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 9' ' ' M3L . . . . . 0.53 ' HA ' HD22 ' A' ' 39' ' ' ASN . . . . . . . . 0 N--CA 1.488 1.429 0 C-N-CA 122.729 0.412 . . . . 0.0 111.994 176.719 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 29.3 t -167.86 100.19 0.47 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 175.296 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 28.3 m -50.43 -38.32 42.64 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.802 1.241 . . . . 0.0 111.546 177.951 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.41 -57.47 0.19 Allowed Glycine 0 C--N 1.339 0.742 0 N-CA-C 110.359 -1.096 . . . . 0.0 110.359 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 145.28 67.07 0.02 OUTLIER Glycine 0 C--N 1.343 0.943 0 N-CA-C 111.422 -0.671 . . . . 0.0 111.422 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -70.66 93.61 0.94 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 176.94 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 C-N-CA 124.358 1.063 . . . . 0.0 109.737 -177.039 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 . . . . . 0 N--CA 1.47 0.57 0 CA-C-O 120.795 0.331 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.3 p -78.5 119.67 27.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.7 0 C-N-CA 123.153 0.581 . . . . 0.0 110.354 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.475 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.5 p -93.24 137.55 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.566 172.075 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.15 -51.5 8.9 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.614 0.766 . . . . 0.0 110.829 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -161.25 169.45 22.16 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.671 0.607 . . . . 0.0 111.511 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.416 HG11 ' HD2' ' A' ' 20' ' ' TYR . 58.6 t -100.19 143.12 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.286 172.473 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.437 HD12 HD22 ' A' ' 32' ' ' ASN . 72.4 mt -108.52 -39.2 5.47 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.218 1.007 . . . . 0.0 111.429 178.574 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -154.02 166.4 33.13 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 122.755 0.422 . . . . 0.0 110.957 -174.2 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.575 HH11 HD21 ' A' ' 50' ' ' LEU . 53.5 ttt180 -142.2 148.73 38.67 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.738 1.215 . . . . 0.0 110.36 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -152.36 174.56 13.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.723 1.209 . . . . 0.0 109.25 173.958 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.586 HG22 HG22 ' A' ' 18' ' ' VAL . 94.6 t -123.11 116.03 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.667 0.787 . . . . 0.0 109.796 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -118.56 121.24 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.074 0.949 . . . . 0.0 109.369 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 64.05 23.6 13.29 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.86 1.264 . . . . 0.0 112.252 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.51 -23.35 32.64 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.444 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.89 157.33 24.39 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.942 0.897 . . . . 0.0 109.116 176.328 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.586 HG22 HG22 ' A' ' 13' ' ' VAL . 99.4 t -113.08 114.29 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.476 0.71 . . . . 0.0 109.438 -173.981 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.54 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -109.39 134.37 51.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.631 0.773 . . . . 0.0 110.562 -177.801 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.416 ' HD2' HG11 ' A' ' 8' ' ' VAL . 48.8 m-85 -108.77 128.46 54.9 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.055 0.942 . . . . 0.0 109.774 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.92 108.37 9.92 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.615 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 32' ' ' ASN . 57.8 mt -82.8 -174.71 5.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.547 0.689 . . . . 0.0 112.236 -171.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -144.71 112.91 6.47 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 103.947 -2.612 . . . . 0.0 103.947 163.96 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 87.5 m95 -79.03 147.75 32.73 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.012 0.434 . . . . 0.0 111.411 -173.834 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -85.1 -36.21 21.3 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.506 172.525 . . . . . . . . 3 3 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -73.19 -28.98 65.17 Favored Glycine 0 C--N 1.357 1.696 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.317 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -120.43 171.91 8.19 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.769 0.828 . . . . 0.0 110.956 -174.737 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.6 p -70.65 161.78 30.14 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 123.182 0.593 . . . . 0.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.72 -27.09 65.63 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.4 0.68 . . . . 0.0 112.109 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.46 -19.02 34.05 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.449 0.7 . . . . 0.0 111.263 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.53 1.62 41.05 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.37 0.668 . . . . 0.0 110.886 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.474 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 31.1 p-10 -56.96 146.98 25.1 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 124.368 1.067 . . . . 0.0 112.718 175.587 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.2 p -140.9 158.71 43.57 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.4 -173.294 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -76.95 115.95 17.19 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.111 0.965 . . . . 0.0 110.31 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -124.56 131.3 24.14 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.099 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.554 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . 63.8 Cg_endo -70.85 154.61 63.33 Favored 'Trans proline' 0 C--N 1.365 1.395 0 C-N-CA 122.439 2.092 . . . . 0.0 112.438 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -28.34 56.45 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.469 1.107 . . . . 0.0 112.289 178.437 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.554 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.3 pt-20 -66.27 -31.92 73.02 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 123.664 0.603 . . . . 0.0 111.279 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.403 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 3.1 m-20 -93.9 -18.47 21.93 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.942 0.897 . . . . 0.0 111.593 177.925 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.43 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 61.1 mt -76.75 124.86 28.31 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 176.936 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -103.48 23.82 12.0 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 171.258 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.508 ' HB3' ' HB3' ' B' ' 5' ' ' GLN . 21.3 p -112.52 89.67 13.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 123.942 0.897 . . . . 0.0 110.505 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -73.63 -33.02 7.08 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.888 2.392 . . . . 0.0 111.814 173.635 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.96 -50.21 73.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.559 -1.201 . . . . 0.0 111.418 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.422 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 77.8 mt -70.22 -36.84 74.83 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.599 -175.708 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.2 -49.7 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.803 0.441 . . . . 0.0 110.405 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.97 -50.63 72.72 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.573 0.546 . . . . 0.0 110.626 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.62 -38.76 85.81 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 124.056 0.848 . . . . 0.0 111.457 -176.992 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -64.06 -42.92 96.85 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.733 0.813 . . . . 0.0 111.508 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.575 HD21 HH11 ' A' ' 11' ' ' ARG . 84.2 mt -68.52 -35.46 77.5 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.092 0.557 . . . . 0.0 110.396 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -66.4 -31.34 72.04 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.136 0.974 . . . . 0.0 110.948 175.072 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 123.377 0.671 . . . . 0.0 110.833 177.276 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.508 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.7 mm-40 . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 28.2 p -97.71 147.38 24.42 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.391 0.676 . . . . 0.0 111.215 -175.316 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.12 144.02 24.53 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.145 0.978 . . . . 0.0 109.845 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 16.1 mtp180 . . . . . 0 N--CA 1.469 0.498 0 C-N-CA 124.182 0.993 . . . . 0.0 108.69 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.1 t80 . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.42 109.71 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.544 0.738 . . . . 0.0 111.887 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.528 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.7 p -85.11 137.48 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 165.141 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -76.74 -54.64 6.36 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.199 0.6 . . . . 0.0 110.311 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.44 ' HA ' HD13 ' A' ' 45' ' ' LEU . 19.3 ptmt -160.28 164.94 32.23 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.001 0.52 . . . . 0.0 111.97 177.76 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.439 HG11 ' HD2' ' A' ' 20' ' ' TYR . 89.6 t -86.73 134.58 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.356 1.062 . . . . 0.0 109.614 171.977 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.2 mt -101.6 -39.15 7.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.507 0.723 . . . . 0.0 110.887 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -149.41 165.37 32.27 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.518 0.327 . . . . 0.0 110.696 -172.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -132.97 144.03 49.85 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.277 1.031 . . . . 0.0 109.154 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.34 172.44 15.38 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.778 0.831 . . . . 0.0 109.684 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 18' ' ' VAL . 76.5 t -127.5 121.95 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.302 1.041 . . . . 0.0 108.976 175.2 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.468 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 69.2 t -129.38 125.79 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 63.96 20.0 12.01 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.412 1.085 . . . . 0.0 112.332 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.79 -12.86 62.63 Favored Glycine 0 C--N 1.348 1.244 0 CA-C-O 119.949 -0.362 . . . . 0.0 113.974 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptpt -98.4 165.32 11.9 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.404 0.602 . . . . 0.0 109.459 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 13' ' ' VAL . 56.5 t -107.96 119.37 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.12 0.568 . . . . 0.0 109.685 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.7 mt-10 -110.16 139.0 45.77 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.406 0.682 . . . . 0.0 110.211 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HD2' HG11 ' A' ' 8' ' ' VAL . 61.7 m-85 -111.57 140.68 45.98 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.659 0.784 . . . . 0.0 110.11 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -79.08 108.04 12.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.469 HD22 HG21 ' A' ' 5' ' ' VAL . 23.2 mt -95.37 120.47 35.67 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.115 0.566 . . . . 0.0 110.757 -174.883 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.757 ' HD3' ' HA ' ' A' ' 29' ' ' ASP . 0.0 OUTLIER -91.62 113.03 25.19 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 166.33 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.528 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 68.9 m95 -79.06 150.12 31.94 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.817 0.847 . . . . 0.0 111.03 -173.541 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -88.79 -39.37 13.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.944 0.498 . . . . 0.0 111.156 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.67 -33.37 60.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.217 177.804 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -94.03 162.44 13.88 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.398 0.679 . . . . 0.0 110.289 174.089 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.1 p -72.36 172.11 10.97 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.507 0.723 . . . . 0.0 111.631 -177.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.757 ' HA ' ' HD3' ' A' ' 23' ' ' LYS . 1.2 m-20 -69.44 -17.59 63.65 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.281 0.632 . . . . 0.0 110.919 173.341 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.75 -19.09 60.37 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.778 0.831 . . . . 0.0 111.7 173.787 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -121.78 85.36 2.4 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.634 0.731 . . . . 0.0 109.466 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.433 ' HB3' ' HA ' ' A' ' 23' ' ' LYS . 6.9 p30 -125.61 136.48 53.31 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.749 1.22 . . . . 0.0 110.179 173.674 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.2 p -130.85 154.79 47.68 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.656 0.783 . . . . 0.0 111.114 -173.375 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -80.84 123.68 28.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.967 0.907 . . . . 0.0 110.313 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -123.79 138.94 31.29 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 123.186 0.594 . . . . 0.0 109.563 171.482 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 60.9 Cg_endo -68.83 158.94 55.84 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 122.726 2.284 . . . . 0.0 112.302 175.878 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.463 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 11.3 pt-20 -65.74 -26.05 67.56 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.106 0.562 . . . . 0.0 111.615 -175.816 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.482 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.9 pt-20 -62.07 -32.19 72.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.959 0.904 . . . . 0.0 110.971 175.227 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.425 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 7.9 m-20 -80.09 -32.32 39.2 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.85 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.465 ' CD2' HD11 ' A' ' 22' ' ' LEU . 13.4 mt -72.27 131.97 43.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.055 -176.983 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -123.97 66.38 1.04 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.688 ' SG ' ' HG2' ' B' ' 5' ' ' GLN . 36.2 t -152.6 112.07 2.77 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 114.38 -1.282 . . . . 0.0 110.353 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -78.71 -23.54 8.14 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.125 1.883 . . . . 0.0 111.885 168.314 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -63.32 -58.7 6.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.987 0.915 . . . . 0.0 111.872 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.452 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 87.5 mt -72.18 -39.16 68.85 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.642 0.777 . . . . 0.0 112.285 -169.947 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.7 mt -65.41 -51.2 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 123.692 0.62 . . . . 0.0 110.406 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -66.0 -40.66 91.34 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.076 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.29 -37.06 86.01 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.832 0.453 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.13 -46.27 91.26 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.783 0.833 . . . . 0.0 110.534 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.2 mt -68.48 -37.22 79.95 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.145 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -82.61 -14.86 54.05 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.635 0.774 . . . . 0.0 112.077 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 t . . . . . 0 N--CA 1.485 1.29 0 C-N-CA 123.171 0.588 . . . . 0.0 109.901 174.44 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.688 ' HG2' ' SG ' ' A' ' 42' ' ' CYS . 27.2 mp0 . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 54.1 m -72.06 117.78 14.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.449 1.1 . . . . 0.0 109.707 177.372 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.67 110.81 7.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.05 0.54 . . . . 0.0 109.918 176.796 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 39.6 ttt180 . . . . . 0 CA--C 1.536 0.431 0 C-N-CA 124.548 1.139 . . . . 0.0 111.085 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.47 HG13 ' O ' ' A' ' 25' ' ' LYS . 3.0 p -113.23 125.18 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 123.124 0.57 . . . . 0.0 110.658 -174.554 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.586 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.1 p -114.88 140.04 38.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 124.677 1.191 . . . . 0.0 110.405 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -73.24 -57.34 4.09 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.365 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.472 ' HA ' HD22 ' A' ' 45' ' ' LEU . 21.2 ptmt -164.2 162.57 22.76 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.307 0.575 . . . . 0.0 112.368 -174.722 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.528 HG23 ' HB3' ' A' ' 45' ' ' LEU . 93.3 t -84.3 143.7 11.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-N 114.649 -1.159 . . . . 0.0 108.857 169.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.54 -42.57 4.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.236 0.614 . . . . 0.0 110.577 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -151.77 164.86 36.1 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.84 0.456 . . . . 0.0 110.538 -171.871 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.4 ' HB2' ' HE2' ' A' ' 49' ' ' PHE . 77.3 ttt180 -124.18 159.54 29.87 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.415 1.086 . . . . 0.0 110.206 -174.941 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -159.43 167.09 29.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.634 0.774 . . . . 0.0 109.329 173.417 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -121.89 121.11 63.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.522 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 89.9 t -125.3 114.85 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.239 1.016 . . . . 0.0 109.041 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 65.78 12.06 8.05 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.329 1.051 . . . . 0.0 112.275 174.474 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 110.56 -25.04 16.06 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 123.315 0.484 . . . . 0.0 113.37 -174.698 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.8 ptpt -81.52 174.26 11.6 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 85.1 t -120.79 123.77 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.61 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 39.9 mt-10 -105.51 138.33 41.88 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.228 0.537 . . . . 0.0 110.341 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -111.84 136.66 50.83 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.548 1.139 . . . . 0.0 109.171 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -80.21 105.56 11.57 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.433 HD22 HG21 ' A' ' 5' ' ' VAL . 23.5 mt -91.62 112.63 24.63 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.512 -175.973 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 32' ' ' ASN . 0.1 OUTLIER -85.0 105.83 16.05 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 165.727 . . . . . . . . 3 3 . 1 . 003 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.586 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 80.3 m95 -73.84 154.01 39.66 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.439 0.695 . . . . 0.0 112.039 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 4' ' ' VAL . 25.4 ttpp -112.14 151.41 29.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.1 -48.32 4.01 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -174.627 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -66.96 165.62 15.21 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.201 1.0 . . . . 0.0 109.584 165.248 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -65.75 152.43 44.32 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-O 120.812 0.339 . . . . 0.0 110.988 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.45 -31.56 70.95 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.764 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.38 -17.46 56.43 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.192 0.597 . . . . 0.0 111.597 176.495 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -84.59 65.32 8.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.856 0.862 . . . . 0.0 109.486 -178.718 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.563 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 16.2 p30 -111.03 149.08 31.24 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.006 1.322 . . . . 0.0 110.57 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 52.5 p -139.36 164.52 29.62 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.938 0.895 . . . . 0.0 110.476 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -86.15 123.78 31.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.72 133.69 24.99 Favored Pre-proline 0 N--CA 1.472 0.634 0 C-N-CA 122.818 0.447 . . . . 0.0 110.576 172.678 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.61 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 43.7 Cg_endo -65.77 160.61 42.88 Favored 'Trans proline' 0 C--N 1.366 1.485 0 C-N-CA 122.572 2.181 . . . . 0.0 112.384 176.691 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -25.47 65.58 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.62 1.168 . . . . 0.0 112.021 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.437 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 13.0 pt-20 -68.68 -23.02 64.34 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.406 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -89.98 -22.58 21.85 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.689 1.195 . . . . 0.0 111.488 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.421 ' CD2' HD11 ' A' ' 22' ' ' LEU . 21.1 mt -77.79 117.0 18.74 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.901 0.48 . . . . 0.0 111.426 -172.024 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.29 -27.56 27.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.508 ' SG ' ' HG ' ' A' ' 45' ' ' LEU . 51.1 t -80.62 109.38 12.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 123.891 0.876 . . . . 0.0 110.714 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -79.07 -17.86 11.66 Favored 'Trans proline' 0 C--N 1.377 2.037 0 C-N-CA 122.274 1.983 . . . . 0.0 111.476 173.551 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.441 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 12.7 tp10 -65.52 -52.44 52.59 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 124.644 1.178 . . . . 0.0 110.917 -176.693 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.528 ' HB3' HG23 ' A' ' 8' ' ' VAL . 75.3 mt -64.9 -29.23 70.16 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.196 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.513 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 31.7 mt -70.63 -55.84 12.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.23 -55.83 21.65 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.474 -170.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.74 79.28 Favored 'General case' 0 N--CA 1.481 1.109 0 O-C-N 124.082 0.863 . . . . 0.0 111.611 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.4 ' HE2' ' HB2' ' A' ' 11' ' ' ARG . 58.0 t80 -63.98 -39.03 93.2 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.463 1.105 . . . . 0.0 111.727 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 89.7 mt -67.76 -38.11 83.01 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.535 0.334 . . . . 0.0 110.281 178.394 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.04 -28.33 65.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.664 . . . . 0.0 111.195 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 123.243 0.617 . . . . 0.0 111.451 176.737 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 . . . . . 0 N--CA 1.471 0.595 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 19.2 m -111.02 150.14 29.73 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 121.49 0.662 . . . . 0.0 111.151 -165.652 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.49 18.39 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 124.934 1.293 . . . . 0.0 109.381 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.38 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.475 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 11.1 m -66.75 134.0 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.019 176.768 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -101.97 131.65 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.568 0.747 . . . . 0.0 109.351 173.715 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.37 -56.28 7.05 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.379 0.671 . . . . 0.0 110.585 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.481 ' HA ' HD22 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -159.3 163.07 36.05 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.121 0.486 . . . . 0.0 111.673 -177.234 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 45' ' ' LEU . 72.2 t -82.04 129.19 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.586 171.603 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.3 mt -86.67 -54.5 4.35 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.199 1.0 . . . . 0.0 110.176 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -151.9 164.51 36.95 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.27 -172.96 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -131.17 141.22 50.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.392 1.077 . . . . 0.0 109.297 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -136.45 171.05 15.06 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.786 0.834 . . . . 0.0 109.561 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 17' ' ' LYS . 90.4 t -124.1 115.2 44.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 124.205 1.002 . . . . 0.0 108.95 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.421 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 92.4 t -126.31 127.97 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.161 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.7 t30 66.08 15.86 10.24 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.2 1.0 . . . . 0.0 111.031 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.54 14.57 75.74 Favored Glycine 0 C--N 1.35 1.33 0 CA-C-N 116.03 -0.532 . . . . 0.0 113.651 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 14.5 ptmt -108.92 157.25 18.8 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.4 t -96.67 125.24 49.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.554 0.741 . . . . 0.0 109.742 177.464 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 47.1 mt-10 -120.93 135.98 55.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.389 0.676 . . . . 0.0 109.997 174.336 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.414 ' HE2' ' HB3' ' A' ' 37' ' ' GLU . 96.3 m-85 -109.79 129.47 55.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.447 1.099 . . . . 0.0 109.893 177.693 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.23 107.95 8.82 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 174.985 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 5' ' ' VAL . 18.3 mt -102.66 127.44 49.77 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 122.876 0.47 . . . . 0.0 111.347 -172.314 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? -96.01 121.28 37.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.58 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.458 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 66.4 m95 -82.2 137.77 34.84 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.147 0.579 . . . . 0.0 111.27 -173.025 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.411 ' HB3' HG23 ' A' ' 4' ' ' VAL . 37.7 ttpt -76.6 132.28 39.36 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 123.665 0.786 . . . . 0.0 110.576 -173.872 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.78 -0.24 89.58 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.689 0.618 . . . . 0.0 113.834 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -104.86 173.36 6.33 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.324 1.05 . . . . 0.0 110.966 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.1 p -65.44 162.05 18.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.791 0.836 . . . . 0.0 112.015 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.81 -41.6 99.36 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.532 0.733 . . . . 0.0 111.248 -176.894 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.63 -16.59 63.41 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.256 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -81.24 77.73 8.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.139 0.976 . . . . 0.0 109.168 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -143.02 131.51 22.33 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 113.987 -1.461 . . . . 0.0 109.794 175.242 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 p -131.74 147.42 52.5 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.957 0.903 . . . . 0.0 110.465 -173.809 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -76.49 109.53 10.3 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.88 0.472 . . . . 0.0 110.041 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -114.12 129.69 24.59 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.403 1.081 . . . . 0.0 110.458 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 72.7 Cg_endo -72.29 150.81 53.56 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.442 2.095 . . . . 0.0 111.985 175.799 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.514 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.06 -26.69 64.84 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.319 1.048 . . . . 0.0 113.09 -176.671 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.85 -31.56 72.58 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.658 0.783 . . . . 0.0 111.215 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -91.44 -14.23 30.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.033 0.933 . . . . 0.0 110.555 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.514 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 10.0 mt -79.07 141.01 37.74 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.786 0.434 . . . . 0.0 110.096 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -97.06 0.2 48.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.247 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.513 ' HA ' ' HG2' ' B' ' 5' ' ' GLN . 33.5 t -111.02 96.98 32.55 Favored Pre-proline 0 C--N 1.356 0.848 0 C-N-CA 123.661 0.785 . . . . 0.0 111.453 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -78.85 -17.15 12.41 Favored 'Trans proline' 0 C--N 1.375 1.953 0 C-N-CA 122.665 2.243 . . . . 0.0 111.578 169.956 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -71.13 -43.94 66.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.024 0.929 . . . . 0.0 110.737 -176.606 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 7' ' ' LYS . 21.2 mt -68.35 -40.18 81.61 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.124 0.569 . . . . 0.0 111.55 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.528 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 66.6 mt -58.62 -52.15 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 123.814 0.696 . . . . 0.0 109.781 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.9 -52.66 64.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.568 0.747 . . . . 0.0 111.298 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.32 71.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.856 0.862 . . . . 0.0 111.598 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.7 -45.3 71.96 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.129 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 79.9 mt -64.85 -35.97 82.85 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 110.403 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -74.04 -29.09 61.73 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.101 0.96 . . . . 0.0 110.299 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 24.8 t . . . . . 0 CA--C 1.552 1.035 0 C-N-CA 123.43 0.692 . . . . 0.0 110.626 177.306 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.513 ' HG2' ' HA ' ' A' ' 42' ' ' CYS . 25.3 tp60 . . . . . 0 CA--C 1.545 0.778 0 CA-C-O 121.38 0.61 . . . . 0.0 111.457 . . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 2.0 m -107.02 171.88 7.13 Favored 'General case' 0 CA--C 1.561 1.374 0 C-N-CA 124.021 0.928 . . . . 0.0 110.729 -166.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.8 144.46 17.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.751 0.82 . . . . 0.0 109.423 171.473 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 . . . . . 0 N--CA 1.479 0.994 0 C-N-CA 122.977 0.511 . . . . 0.0 109.995 177.127 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 . . . . . 0 N--CA 1.473 0.712 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -80.66 110.81 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.825 0.821 . . . . 0.0 110.388 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.416 HG21 HD22 ' A' ' 22' ' ' LEU . 1.4 p -81.6 131.39 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.733 168.353 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.505 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 39.1 tt0 -74.94 -49.49 19.97 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 174.427 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.89 162.42 29.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.318 0.58 . . . . 0.0 111.015 -172.825 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.488 HG11 ' HD2' ' A' ' 20' ' ' TYR . 61.1 t -89.99 141.27 14.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.363 172.145 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.3 mt -105.42 -47.6 3.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.96 0.904 . . . . 0.0 109.918 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -144.62 164.47 30.85 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 55.6 ttt180 -138.75 126.5 22.16 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.324 1.05 . . . . 0.0 109.509 -175.595 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -126.83 164.17 21.98 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.761 0.824 . . . . 0.0 109.856 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.8 t -125.61 116.79 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.2 t -123.62 118.9 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.088 0.955 . . . . 0.0 109.559 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 62.34 32.6 16.88 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.811 1.245 . . . . 0.0 111.784 175.493 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.2 -26.81 11.8 Favored Glycine 0 N--CA 1.472 1.046 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.301 -177.478 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -79.44 152.74 30.14 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 123.995 0.918 . . . . 0.0 109.48 -177.811 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.9 t -114.34 113.69 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.546 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 49.7 mt-10 -106.49 153.47 22.25 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.971 0.908 . . . . 0.0 110.536 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.488 ' HD2' HG11 ' A' ' 8' ' ' VAL . 92.6 m-85 -132.01 126.88 35.02 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.296 1.038 . . . . 0.0 108.95 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -77.55 107.47 10.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.416 HD22 HG21 ' A' ' 5' ' ' VAL . 42.3 mt -96.71 123.34 40.37 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.112 0.565 . . . . 0.0 111.734 -168.987 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -73.83 106.05 5.38 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 165.474 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.496 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 76.4 m95 -78.93 116.92 19.55 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 173.851 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . 38.7 ttpt -61.9 -41.05 97.43 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.756 0.823 . . . . 0.0 112.338 -170.449 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.62 5.83 79.99 Favored Glycine 0 CA--C 1.534 1.274 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -132.09 170.73 14.56 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.691 0.796 . . . . 0.0 111.407 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 77.5 p -72.83 160.99 31.29 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.533 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.9 -29.56 63.24 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.342 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -22.43 63.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.991 0.516 . . . . 0.0 111.351 174.926 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -92.29 -1.13 57.28 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.541 0.737 . . . . 0.0 111.164 -178.506 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.496 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 84.4 m-20 -64.89 139.49 58.77 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.978 0.511 . . . . 0.0 110.666 173.372 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 39.5 p -131.57 155.77 46.92 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.185 0.594 . . . . 0.0 112.116 -170.894 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -77.3 113.48 15.12 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.532 0.733 . . . . 0.0 109.444 171.978 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -121.9 129.56 25.1 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 122.913 0.485 . . . . 0.0 110.379 176.647 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.546 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 73.4 Cg_endo -71.75 149.89 55.23 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 122.737 2.291 . . . . 0.0 112.18 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.445 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 9.5 pt-20 -60.28 -24.0 64.58 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.867 0.867 . . . . 0.0 112.741 -175.405 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.51 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 9.3 pt-20 -65.81 -35.36 80.48 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.902 0.881 . . . . 0.0 111.307 175.773 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -82.42 -21.94 35.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.386 1.074 . . . . 0.0 110.687 -175.191 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.532 HD22 ' HB1' ' B' ' 7' ' ' ALA . 7.6 mt -86.14 142.14 28.87 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -108.75 26.13 10.93 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 173.382 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 47.0 t -117.28 90.85 35.4 Favored Pre-proline 0 C--N 1.346 0.451 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.902 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -70.96 -22.16 26.93 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 122.507 2.138 . . . . 0.0 111.013 170.202 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.86 -60.18 3.95 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 124.118 0.967 . . . . 0.0 111.445 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.44 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 89.6 mt -78.22 -29.73 48.45 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.802 0.441 . . . . 0.0 112.027 -172.031 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 93.0 mt -63.68 -56.08 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -41.56 69.66 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.594 -174.385 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -34.23 77.68 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.046 0.216 . . . . 0.0 111.148 -177.871 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -60.42 -44.21 95.98 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.606 0.762 . . . . 0.0 110.799 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 69.4 mt -66.92 -39.02 87.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.781 178.019 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -71.61 -21.77 61.8 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.904 0.882 . . . . 0.0 111.42 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.477 0.911 0 C-N-CA 123.064 0.545 . . . . 0.0 110.226 173.702 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.479 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 20.5 tp60 . . . . . 0 CA--C 1.545 0.756 0 CA-C-O 120.948 0.404 . . . . 0.0 110.029 . . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -86.75 173.98 9.12 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 124.106 0.963 . . . . 0.0 113.075 -160.419 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' B' B ' 7' ' ' ALA . . . . . 0.532 ' HB1' HD22 ' A' ' 40' ' ' LEU . . . -147.78 155.06 41.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 . . . . . 0 CA--C 1.548 0.896 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.158 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.453 ' HE2' ' H ' ' A' ' 26' ' ' GLY . 47.1 t80 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 65.5 t -77.68 116.87 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.086 0.555 . . . . 0.0 110.926 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.455 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.2 p -92.55 142.0 13.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 123.863 0.865 . . . . 0.0 110.66 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -79.64 -57.85 3.47 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.173 0.989 . . . . 0.0 110.848 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -160.81 169.39 22.8 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.794 0.438 . . . . 0.0 111.866 -175.33 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.441 HG13 ' HB3' ' A' ' 20' ' ' TYR . 43.9 t -92.17 141.45 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.061 0.944 . . . . 0.0 109.194 171.057 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.1 mt -111.43 -35.4 5.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.508 1.123 . . . . 0.0 110.786 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -157.26 164.62 37.49 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.434 0.694 . . . . 0.0 109.812 -173.299 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -132.7 154.02 50.56 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.985 0.914 . . . . 0.0 109.971 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.24 161.47 40.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.956 0.902 . . . . 0.0 109.28 174.788 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t -116.87 124.19 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 169.571 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.0 t -112.49 108.83 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 176.384 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.5 m120 64.97 -73.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.153 1.381 . . . . 0.0 111.033 -172.961 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -147.72 -9.34 0.2 Allowed Glycine 0 CA--C 1.528 0.852 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.607 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' A' ' 36' ' ' PRO . 15.6 ptmt -81.28 170.47 16.02 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.543 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 99.1 t -124.51 127.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.139 0.576 . . . . 0.0 109.497 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -118.33 139.52 51.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.441 ' HB3' HG13 ' A' ' 8' ' ' VAL . 98.0 m-85 -111.28 132.66 54.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.293 1.037 . . . . 0.0 109.641 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -78.42 108.56 11.86 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.8 mt -101.41 123.04 44.84 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.34 0.656 . . . . 0.0 112.169 -168.065 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -78.07 110.13 12.76 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 165.737 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.559 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 71.9 m95 -80.7 148.95 29.94 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 122.862 0.465 . . . . 0.0 110.342 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -58.52 -48.44 80.84 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 123.67 0.606 . . . . 0.0 110.94 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLY . . . . . 0.453 ' H ' ' HE2' ' A' ' 3' ' ' PHE . . . -103.76 15.3 52.61 Favored Glycine 0 C--N 1.34 0.805 0 CA-C-N 115.584 -0.735 . . . . 0.0 114.207 -173.374 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.559 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 55.5 m-85 -132.83 136.64 46.38 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 117.605 0.702 . . . . 0.0 109.925 175.267 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.5 p -80.71 -179.22 7.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.292 1.037 . . . . 0.0 111.835 -175.662 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.422 ' HA ' ' ND2' ' A' ' 32' ' ' ASN . 33.1 t70 -49.83 -51.45 39.83 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.135 1.374 . . . . 0.0 113.582 -170.313 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.12 -20.84 62.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 27' ' ' PHE . 11.1 t70 -91.25 -17.85 25.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.833 0.453 . . . . 0.0 111.209 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.422 ' ND2' ' HA ' ' A' ' 29' ' ' ASP . 84.1 m-20 -58.17 136.99 57.36 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.479 0.712 . . . . 0.0 111.672 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.8 p -128.41 156.79 42.6 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.372 0.669 . . . . 0.0 112.669 -166.758 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -80.32 117.53 21.16 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.095 0.958 . . . . 0.0 110.369 173.618 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -118.66 135.52 23.72 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 123.006 0.523 . . . . 0.0 110.311 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.509 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . 94.9 Cg_endo -74.55 150.94 41.29 Favored 'Trans proline' 0 C--N 1.365 1.425 0 C-N-CA 122.463 2.109 . . . . 0.0 112.511 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -27.69 64.46 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.032 0.933 . . . . 0.0 112.572 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 15.7 pt-20 -60.7 -35.75 77.08 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.199 0.6 . . . . 0.0 110.94 177.326 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -83.51 -34.78 25.24 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.788 0.835 . . . . 0.0 111.149 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.528 HD12 HD11 ' A' ' 46' ' ' ILE . 19.2 mt -62.78 136.75 58.03 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -170.172 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -108.57 29.52 7.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 171.731 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.473 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 19.7 m -116.27 89.51 26.39 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.262 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.97 -26.48 6.58 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.742 1.628 . . . . 0.0 111.097 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.51 -56.14 13.99 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 124.328 1.051 . . . . 0.0 111.127 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.541 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 83.9 mt -65.95 -40.26 91.17 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.677 0.61 . . . . 0.0 111.638 -174.012 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.528 HD11 HD12 ' A' ' 40' ' ' LEU . 76.5 mt -66.36 -47.94 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.472 0.483 . . . . 0.0 110.54 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.34 -50.85 72.16 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.317 0.647 . . . . 0.0 110.794 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -37.25 85.92 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.534 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -64.2 -49.75 70.79 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.132 0.973 . . . . 0.0 110.805 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 80.0 mt -66.24 -38.61 88.3 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.904 -177.728 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -78.16 -18.32 55.71 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.8 t . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 120.898 0.38 . . . . 0.0 110.016 174.162 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.541 ' HG3' ' HG ' ' A' ' 45' ' ' LEU . 87.4 mm-40 . . . . . 0 N--CA 1.469 0.486 0 CA-C-O 120.742 0.306 . . . . 0.0 110.556 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 37.4 m -110.63 137.35 48.43 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.534 0.733 . . . . 0.0 109.24 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -129.1 145.47 51.28 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.866 0.866 . . . . 0.0 108.988 176.604 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 67.2 mtt85 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.852 -172.585 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 . . . . . 0 N--CA 1.469 0.488 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.513 HG22 HG22 ' B' ' 6' ' ' THR . 47.0 t -84.35 132.08 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 176.192 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.498 HG21 HD22 ' A' ' 22' ' ' LEU . 1.2 p -100.88 121.8 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 109.325 -0.621 . . . . 0.0 109.325 172.461 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 14.8 tp10 -53.59 -57.22 11.52 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.554 1.142 . . . . 0.0 110.821 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -164.21 162.03 22.42 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 -174.26 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.494 HG13 ' HB3' ' A' ' 20' ' ' TYR . 85.9 t -85.28 116.71 29.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.599 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.1 mt -82.9 -35.69 25.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.013 0.525 . . . . 0.0 111.888 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -164.56 162.73 21.84 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.259 0.349 . . . . 0.0 110.995 -171.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.484 ' NH2' HD21 ' A' ' 50' ' ' LEU . 31.3 ttm180 -118.59 149.26 41.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.309 1.044 . . . . 0.0 109.539 173.538 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -132.2 160.78 35.12 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 165.651 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 85.9 t -120.95 108.46 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 167.327 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.61 128.56 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.371 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 66.02 22.2 11.23 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.843 1.257 . . . . 0.0 111.772 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.45 6.08 89.05 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.781 -0.645 . . . . 0.0 113.357 -176.056 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -104.26 143.13 33.37 Favored 'General case' 0 C--N 1.348 0.523 0 C-N-CA 124.285 1.034 . . . . 0.0 109.702 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -91.08 119.45 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.402 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.53 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 43.0 mt-10 -128.19 162.71 26.34 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.144 0.978 . . . . 0.0 109.576 -178.919 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.494 ' HB3' HG13 ' A' ' 8' ' ' VAL . 87.7 m-85 -140.68 134.45 30.39 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.528 0.731 . . . . 0.0 110.147 -172.56 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -78.51 106.94 10.81 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 174.502 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.688 HD11 HD22 ' A' ' 40' ' ' LEU . 28.4 mt -87.98 123.35 32.6 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.351 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -78.11 99.45 6.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.052 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.551 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 63.0 m95 -63.88 126.26 27.05 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 171.427 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.571 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 38.0 ttpt -51.21 -54.44 25.59 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.411 1.484 . . . . 0.0 113.516 -164.589 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.75 30.69 9.78 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 116.78 -0.191 . . . . 0.0 112.855 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.551 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.6 m-85 -135.55 142.21 45.33 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.375 0.67 . . . . 0.0 110.234 -178.859 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.8 p -64.75 159.24 22.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.251 1.02 . . . . 0.0 112.141 -175.506 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.23 -34.81 78.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.298 0.639 . . . . 0.0 112.064 -177.005 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.82 -19.3 64.27 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.424 0.69 . . . . 0.0 111.546 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -99.82 -18.4 17.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.452 1.101 . . . . 0.0 110.844 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.482 ' HB3' ' O ' ' A' ' 22' ' ' LEU . 11.8 m120 -68.11 146.61 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.195 0.598 . . . . 0.0 111.183 175.821 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 42.7 p -126.07 165.06 19.54 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.32 0.648 . . . . 0.0 112.358 -166.333 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -88.4 116.9 26.95 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.993 0.917 . . . . 0.0 109.847 173.089 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -121.8 133.62 24.35 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 123.688 0.795 . . . . 0.0 110.744 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.53 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 58.2 Cg_endo -69.26 156.07 65.72 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.591 2.194 . . . . 0.0 111.667 176.472 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.419 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -51.49 -30.16 19.08 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.367 1.067 . . . . 0.0 113.43 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.42 -37.91 80.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.336 0.654 . . . . 0.0 110.983 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -89.83 3.26 53.49 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.491 0.717 . . . . 0.0 111.1 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.688 HD22 HD11 ' A' ' 22' ' ' LEU . 10.8 mt -88.66 124.25 33.9 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.994 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.451 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 32.5 t70 -84.1 -33.57 24.32 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 175.946 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.564 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 17.6 p -71.57 109.44 5.52 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 124.403 1.081 . . . . 0.0 110.839 174.364 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.451 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 73.4 Cg_endo -87.12 -19.39 2.52 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.253 1.968 . . . . 0.0 111.953 170.923 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.57 -35.58 60.57 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.932 0.893 . . . . 0.0 110.789 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.2 mt -69.98 -32.63 70.94 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.614 0.366 . . . . 0.0 110.865 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 29.3 mt -68.49 -46.56 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.13 -45.23 94.36 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.51 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.74 -32.14 73.25 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.173 0.589 . . . . 0.0 111.627 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.45 -40.19 96.48 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.85 0.86 . . . . 0.0 110.501 173.08 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.484 HD21 ' NH2' ' A' ' 11' ' ' ARG . 91.4 mt -73.22 -34.79 66.11 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.363 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 12.7 m120 -76.7 -14.97 59.91 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.835 0.854 . . . . 0.0 111.084 179.578 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.3 t . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.868 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.564 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 46.1 tt0 . . . . . 0 CA--C 1.553 1.079 0 CA-C-O 122.227 1.013 . . . . 0.0 108.563 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.513 HG22 HG22 ' A' ' 4' ' ' VAL . 21.8 p -96.27 179.42 5.05 Favored 'General case' 0 C--O 1.246 0.92 0 C-N-CA 124.284 1.033 . . . . 0.0 111.55 -176.425 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -176.97 179.97 0.98 Allowed 'General case' 0 C--O 1.246 0.912 0 C-N-CA 125.336 1.454 . . . . 0.0 108.71 177.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.1 ttp85 . . . . . 0 N--CA 1.471 0.601 0 C-N-CA 123.805 0.842 . . . . 0.0 108.839 -179.561 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.65 122.5 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.551 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -97.26 134.9 33.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 123.657 0.783 . . . . 0.0 109.427 175.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.0 -55.98 9.18 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.003 0.921 . . . . 0.0 109.752 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -162.92 166.75 23.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.443 0.697 . . . . 0.0 110.875 -174.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.414 HG11 ' HD2' ' A' ' 20' ' ' TYR . 60.0 t -90.41 142.34 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 169.941 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.7 mt -106.77 -45.58 4.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.707 0.803 . . . . 0.0 111.058 -178.808 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -149.6 161.85 41.35 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.811 0.339 . . . . 0.0 110.933 -175.559 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -122.42 151.87 40.8 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.092 1.357 . . . . 0.0 108.605 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -153.23 163.58 39.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.123 0.569 . . . . 0.0 110.272 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.2 t -117.59 115.11 47.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 123.961 0.904 . . . . 0.0 109.178 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.413 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 88.6 t -116.45 109.85 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.362 1.065 . . . . 0.0 109.47 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.8 m120 60.93 17.92 8.32 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 124.303 1.041 . . . . 0.0 112.851 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.91 -24.38 14.93 Favored Glycine 0 C--N 1.347 1.159 0 CA-C-O 119.829 -0.428 . . . . 0.0 113.367 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptmt -81.92 170.98 14.99 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.951 0.5 . . . . 0.0 109.823 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -120.54 118.57 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.229 0.612 . . . . 0.0 110.214 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.571 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 61.6 mt-10 -111.02 152.23 27.09 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.809 0.844 . . . . 0.0 110.687 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.434 ' HE1' ' HB3' ' A' ' 37' ' ' GLU . 94.0 m-85 -130.09 126.9 38.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.651 1.18 . . . . 0.0 109.268 -176.216 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -78.32 108.35 11.6 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.481 HD11 HD22 ' A' ' 40' ' ' LEU . 39.9 mt -90.29 122.39 33.15 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 -174.225 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.37 96.79 6.11 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 163.189 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.5 m95 -67.88 135.27 52.23 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.364 0.415 . . . . 0.0 110.241 179.231 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -69.92 131.25 44.13 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.9 -35.27 3.82 Favored Glycine 0 C--N 1.347 1.145 0 O-C-N 123.314 0.384 . . . . 0.0 112.903 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.56 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 64.6 m-85 -91.65 144.74 25.21 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.636 0.775 . . . . 0.0 109.875 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.1 p -73.77 163.37 28.05 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.861 0.864 . . . . 0.0 112.1 -174.173 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.429 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.9 p-10 -59.55 -33.76 71.82 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.846 0.858 . . . . 0.0 111.389 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.03 -28.1 60.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.846 0.858 . . . . 0.0 111.839 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -88.51 -11.87 44.53 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.491 0.716 . . . . 0.0 111.25 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.552 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.8 m120 -63.25 157.66 22.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.1 p -143.65 154.67 43.76 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.488 0.715 . . . . 0.0 111.403 -172.707 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -77.54 124.02 27.37 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.899 0.88 . . . . 0.0 109.139 171.787 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -124.68 129.63 24.55 Favored Pre-proline 0 N--CA 1.468 0.458 0 C-N-CA 123.15 0.58 . . . . 0.0 110.761 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.571 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 51.4 Cg_endo -66.7 159.82 49.35 Favored 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.685 2.257 . . . . 0.0 111.91 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.434 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -64.69 -24.77 67.68 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.551 0.74 . . . . 0.0 112.786 -176.277 . . . . . . . . 3 3 . 1 . 008 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.02 -31.45 72.64 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.961 0.904 . . . . 0.0 110.624 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.03 -12.86 32.02 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.525 1.13 . . . . 0.0 111.216 -172.6 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.481 HD22 HD11 ' A' ' 22' ' ' LEU . 21.5 mt -86.53 120.97 28.43 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.502 0.721 . . . . 0.0 110.346 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 41' ' ' ASP . . . . . 0.487 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 26.9 t70 -83.08 -30.1 28.26 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 173.451 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.1 p -78.23 106.29 3.87 Favored Pre-proline 0 CA--C 1.559 1.319 0 C-N-CA 124.8 1.24 . . . . 0.0 112.164 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.487 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 64.8 Cg_endo -87.96 -18.51 2.31 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.736 2.291 . . . . 0.0 113.064 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' GLU . . . . . 0.429 ' HB3' ' OE1' ' B' ' 5' ' ' GLN . 35.2 tt0 -75.25 -36.22 61.3 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.722 0.809 . . . . 0.0 110.441 -174.976 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -67.22 -39.7 86.3 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.113 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 62.7 mt -63.39 -47.55 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 176.548 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.97 -53.27 60.25 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.264 1.026 . . . . 0.0 111.296 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.92 -33.63 74.6 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.609 0.764 . . . . 0.0 111.109 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -71.34 -36.87 71.69 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.169 0.988 . . . . 0.0 111.421 176.228 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 96.8 mt -67.83 -36.72 80.85 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 176.537 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -67.27 -28.41 68.01 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.256 1.022 . . . . 0.0 110.529 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 N--CA 1.481 1.101 0 C-N-CA 123.198 0.599 . . . . 0.0 110.557 175.58 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.429 ' OE1' ' HB3' ' A' ' 44' ' ' GLU . 33.3 mm-40 . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 120.79 0.329 . . . . 0.0 111.053 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 8.8 t -127.22 159.87 32.99 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 123.81 0.844 . . . . 0.0 110.43 -173.599 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -156.55 163.83 38.92 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.987 1.315 . . . . 0.0 108.094 173.004 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.469 ' HD2' ' N ' ' B' ' 8' ' ' ARG . 1.8 mpt_? . . . . . 0 N--CA 1.473 0.679 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 18.9 t -78.44 134.0 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 122.75 0.42 . . . . 0.0 110.613 -174.553 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.45 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -112.92 135.82 51.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.865 1.266 . . . . 0.0 110.285 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.689 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 18.1 tp10 -70.05 -54.82 11.42 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.924 1.29 . . . . 0.0 110.962 175.842 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.689 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.19 169.08 5.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.034 0.934 . . . . 0.0 111.104 170.827 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.5 t -77.16 141.26 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.966 172.093 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.1 mt -109.34 -41.15 4.71 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.645 0.778 . . . . 0.0 111.179 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -147.12 164.28 33.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.886 0.474 . . . . 0.0 110.322 -169.333 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -132.89 151.63 52.0 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.423 1.089 . . . . 0.0 110.137 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -148.68 163.89 35.96 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.219 1.007 . . . . 0.0 109.522 174.16 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.0 t -115.99 108.37 24.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 170.08 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.1 t -91.34 110.2 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.5 m120 66.68 -73.3 0.08 Allowed 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.955 1.302 . . . . 0.0 111.201 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -160.26 34.66 0.43 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 175.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.4 ptmt -130.82 151.54 51.14 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.469 0.708 . . . . 0.0 109.601 177.509 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 95.3 t -90.54 130.15 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 122.634 0.374 . . . . 0.0 110.19 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 25.9 mt-10 -124.97 149.05 48.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 109.739 170.379 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.504 ' HB2' HD11 ' A' ' 40' ' ' LEU . 92.4 m-85 -122.93 132.59 54.23 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.22 1.008 . . . . 0.0 110.026 -178.561 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -78.12 109.38 12.16 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.194 0.997 . . . . 0.0 108.778 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.514 HD11 HD22 ' A' ' 40' ' ' LEU . 20.6 mt -88.81 126.07 35.19 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.06 0.544 . . . . 0.0 111.139 -176.488 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -80.0 107.43 12.78 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 162.181 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.529 ' CD1' ' HA ' ' A' ' 32' ' ' ASN . 90.3 m95 -72.33 134.38 45.46 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.591 0.356 . . . . 0.0 110.795 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -69.83 -60.78 2.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.844 0.858 . . . . 0.0 111.158 -173.067 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.76 32.84 6.38 Favored Glycine 0 C--N 1.344 0.976 0 CA-C-N 115.774 -0.648 . . . . 0.0 113.321 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.41 ' HD2' ' HB3' ' A' ' 24' ' ' TRP . 85.4 m-85 -137.27 163.91 29.8 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.124 0.969 . . . . 0.0 108.689 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.7 t -72.57 164.96 25.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.096 0.558 . . . . 0.0 111.619 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -73.12 -42.95 62.36 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.662 0.785 . . . . 0.0 112.692 -165.317 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.53 -13.66 60.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.986 0.515 . . . . 0.0 111.858 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -79.35 -10.89 59.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.218 1.007 . . . . 0.0 111.994 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.529 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 68.5 m-20 -64.99 136.13 56.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.117 0.567 . . . . 0.0 112.319 -174.429 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.3 p -138.4 162.29 34.79 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.249 0.62 . . . . 0.0 112.341 -165.632 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -79.0 123.11 26.98 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.515 1.126 . . . . 0.0 111.123 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.42 ' HB2' HD21 ' A' ' 40' ' ' LEU . 57.2 mm-40 -121.65 135.1 24.88 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 171.913 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 38.5 Cg_endo -65.35 155.87 66.33 Favored 'Trans proline' 0 C--N 1.372 1.764 0 C-N-CA 122.329 2.019 . . . . 0.0 111.333 175.046 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.401 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.01 -26.24 62.13 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.74 0.816 . . . . 0.0 112.502 -178.923 . . . . . . . . 3 3 . 1 . 009 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.424 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 10.4 pt-20 -71.64 -27.94 63.43 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.451 0.701 . . . . 0.0 110.841 178.63 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.484 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.7 m-20 -88.7 -16.37 32.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.924 0.89 . . . . 0.0 111.43 177.636 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.514 HD22 HD11 ' A' ' 22' ' ' LEU . 23.6 mt -77.28 124.9 28.48 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.723 0.409 . . . . 0.0 110.362 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.97 24.0 12.82 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 p -121.29 89.11 46.45 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 123.652 0.781 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' PRO . . . . . 0.434 ' HD2' HE22 ' B' ' 5' ' ' GLN . 29.0 Cg_exo -65.35 -48.17 3.64 Favored 'Trans proline' 0 C--N 1.376 1.982 0 C-N-CA 123.063 2.509 . . . . 0.0 113.736 -177.44 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -64.42 -29.57 70.62 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.696 0.799 . . . . 0.0 112.165 -173.738 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 7' ' ' LYS . 53.1 mt -78.04 -35.84 49.24 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.399 0.68 . . . . 0.0 111.426 -176.669 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 71.6 mt -65.2 -47.51 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.41 -46.02 80.39 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.191 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.13 84.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.028 0.931 . . . . 0.0 110.923 -176.054 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -68.16 -46.35 71.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.918 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.23 -24.25 63.06 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.321 0.649 . . . . 0.0 110.178 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -74.78 -25.75 59.28 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.622 1.169 . . . . 0.0 109.853 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 CA--C 1.548 0.9 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.52 172.924 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.434 HE22 ' HD2' ' A' ' 43' ' ' PRO . 16.0 mm-40 . . . . . 0 CA--C 1.532 0.272 0 CA-C-O 120.961 0.41 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 10.1 t -131.94 179.12 6.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.349 -165.508 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.89 -179.61 8.22 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.84 0.856 . . . . 0.0 110.635 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.484 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 76.6 ttt180 . . . . . 0 N--CA 1.471 0.624 0 C-N-CA 125.082 1.353 . . . . 0.0 107.698 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 30.6 m -73.45 134.86 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.567 0.747 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.434 HG21 HD22 ' A' ' 22' ' ' LEU . 1.7 p -125.79 133.5 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.511 0.724 . . . . 0.0 110.014 174.838 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.822 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 10.6 tp10 -56.11 -64.84 0.73 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.364 1.466 . . . . 0.0 110.58 172.875 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.822 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.83 170.12 4.68 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.313 1.045 . . . . 0.0 110.689 169.831 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 49' ' ' PHE . 63.4 t -66.07 139.55 21.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.07 172.033 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 9' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 23' ' ' LYS . 86.3 mt -111.63 -30.14 7.46 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 123.78 0.832 . . . . 0.0 110.865 -177.869 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -159.43 163.39 35.46 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.638 0.375 . . . . 0.0 110.702 -172.905 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -136.33 147.69 47.53 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.103 0.961 . . . . 0.0 110.397 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -151.09 172.72 15.32 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.473 1.109 . . . . 0.0 108.821 174.593 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -129.98 118.54 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.518 0.727 . . . . 0.0 109.273 174.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.1 t -125.98 123.82 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.078 0.951 . . . . 0.0 109.335 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.9 m120 62.99 26.72 15.64 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.763 1.225 . . . . 0.0 111.969 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.76 -23.5 30.48 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.269 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -77.66 148.95 34.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.711 1.205 . . . . 0.0 109.458 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.9 t -106.12 116.06 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.629 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -104.41 154.62 19.63 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 110.261 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.433 ' HD1' HG11 ' A' ' 8' ' ' VAL . 91.1 m-85 -138.48 124.27 19.86 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.484 1.114 . . . . 0.0 109.519 -175.327 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -78.5 109.3 12.55 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.434 HD22 HG21 ' A' ' 5' ' ' VAL . 54.2 mt -96.36 127.66 42.56 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.613 0.765 . . . . 0.0 111.209 -172.849 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 6' ' ' GLU . 3.4 tmtp? -80.11 96.87 6.63 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 167.18 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.577 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 92.5 m95 -63.95 117.58 7.22 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.4 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 ttpp -66.11 -34.19 77.5 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 124.22 0.95 . . . . 0.0 111.829 -168.571 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.73 16.95 60.13 Favored Glycine 0 C--N 1.343 0.965 0 CA-C-N 115.977 -0.556 . . . . 0.0 113.604 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.439 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 98.7 m-85 -139.01 157.57 45.76 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.662 0.785 . . . . 0.0 110.058 -177.437 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 t -69.09 162.54 26.73 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.274 0.63 . . . . 0.0 111.865 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.68 -34.42 78.17 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.854 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.87 -22.34 60.79 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.088 0.555 . . . . 0.0 111.663 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -88.72 -3.78 58.69 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.833 0.853 . . . . 0.0 110.883 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.577 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.7 m120 -70.03 138.35 52.07 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.06 0.544 . . . . 0.0 111.079 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.0 p -130.36 165.26 22.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.37 0.668 . . . . 0.0 111.821 -170.198 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -83.95 116.41 22.78 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.059 0.944 . . . . 0.0 110.146 173.653 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -117.14 131.56 23.94 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 123.074 0.549 . . . . 0.0 110.116 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.629 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.5 Cg_endo -66.5 165.3 25.56 Favored 'Trans proline' 0 C--N 1.367 1.542 0 C-N-CA 122.392 2.061 . . . . 0.0 113.001 175.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.41 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.22 -29.14 67.3 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.255 1.022 . . . . 0.0 112.546 -178.464 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.35 -34.03 76.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.749 0.819 . . . . 0.0 110.984 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -77.11 -33.64 56.86 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.568 0.747 . . . . 0.0 111.156 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.41 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 34.9 mt -62.08 124.98 22.3 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.517 0.327 . . . . 0.0 111.259 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -108.23 19.54 19.77 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 122.653 1.216 . . . . 0.0 108.151 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.431 ' O ' HG13 ' A' ' 46' ' ' ILE . 12.9 p -127.69 87.52 55.75 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.398 -176.725 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.87 -27.32 26.11 Favored 'Trans proline' 0 C--N 1.377 2.058 0 C-N-CA 122.491 2.127 . . . . 0.0 111.786 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.15 -38.64 82.36 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.696 0.798 . . . . 0.0 111.187 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.554 HD13 ' HA ' ' A' ' 7' ' ' LYS . 77.6 mt -78.73 -23.59 45.37 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.259 0.624 . . . . 0.0 111.312 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 42' ' ' CYS . 79.9 mt -67.3 -52.39 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 169.261 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.16 -44.8 79.63 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.401 1.081 . . . . 0.0 110.994 177.898 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.52 -43.98 97.89 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.64 -177.909 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.468 ' HB2' ' HB ' ' A' ' 8' ' ' VAL . 43.4 t80 -59.43 -47.86 83.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 124.282 0.988 . . . . 0.0 111.102 177.054 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.42 -38.59 84.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.442 0.697 . . . . 0.0 110.548 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.91 -24.63 59.72 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.616 0.766 . . . . 0.0 111.284 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 52.5 m . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 123.266 0.626 . . . . 0.0 111.388 178.827 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 42.8 p -93.2 170.89 9.29 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 122.492 1.139 . . . . 0.0 113.808 -164.901 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.27 -179.82 7.67 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-N 113.737 -1.574 . . . . 0.0 108.692 172.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 . . . . . 0 N--CA 1.467 0.422 0 C-N-CA 123.601 0.761 . . . . 0.0 109.716 -175.798 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.2 t -75.83 130.55 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.494 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -106.57 119.61 56.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.292 0.637 . . . . 0.0 109.927 174.644 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.425 ' HG3' ' HG2' ' A' ' 7' ' ' LYS . 11.7 tp10 -48.35 -57.17 6.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.747 1.619 . . . . 0.0 110.989 172.089 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HG2' ' HG3' ' A' ' 6' ' ' GLU . 3.6 ptpp? -170.36 156.94 5.87 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.72 0.808 . . . . 0.0 110.929 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.427 HG23 ' HB3' ' A' ' 45' ' ' LEU . 85.3 t -71.85 120.27 19.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.869 169.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -87.75 -49.42 7.14 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.265 0.626 . . . . 0.0 110.841 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -147.8 164.88 32.25 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 -170.976 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -137.54 134.73 36.01 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.286 1.034 . . . . 0.0 109.605 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -138.52 175.75 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.325 0.65 . . . . 0.0 109.907 177.004 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -123.18 123.67 68.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 108.452 174.01 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 75.9 t -133.64 122.05 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.766 0.826 . . . . 0.0 109.175 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 66.54 19.67 10.85 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.928 1.291 . . . . 0.0 111.694 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.8 -19.74 53.11 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.923 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -81.66 166.28 20.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.831 0.453 . . . . 0.0 109.85 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.8 t -114.42 110.55 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 123.774 0.83 . . . . 0.0 108.911 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 95.7 mt-10 -104.53 156.1 18.24 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.62 0.768 . . . . 0.0 110.475 -177.726 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.417 ' HD2' HG11 ' A' ' 8' ' ' VAL . 48.0 m-85 -134.9 124.06 24.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.391 1.077 . . . . 0.0 108.444 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -76.72 107.68 9.2 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.577 HD11 HD22 ' A' ' 40' ' ' LEU . 43.0 mt -92.65 123.69 36.12 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.344 -174.632 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -77.38 98.97 5.42 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.634 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 82.9 m95 -67.54 122.01 17.08 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 173.84 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -66.7 -26.99 67.28 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 123.643 0.589 . . . . 0.0 111.905 -175.399 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.28 -7.8 82.35 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-N 116.379 -0.373 . . . . 0.0 113.661 179.471 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -129.44 162.84 27.16 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.593 0.757 . . . . 0.0 110.784 -174.069 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.8 p -73.14 161.63 30.38 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.387 0.675 . . . . 0.0 110.861 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.483 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 21.0 m-20 -57.8 -36.39 72.14 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.576 0.547 . . . . 0.0 110.999 177.902 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.88 -18.0 60.5 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.034 0.934 . . . . 0.0 112.542 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -99.12 -8.1 25.69 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.408 0.283 . . . . 0.0 111.365 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.634 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.9 m120 -65.74 158.55 27.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.452 0.701 . . . . 0.0 112.584 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.0 p -140.76 158.76 43.49 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 121.403 0.621 . . . . 0.0 112.304 -173.494 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -80.67 123.24 28.0 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.862 1.265 . . . . 0.0 109.828 173.525 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -123.3 133.41 24.52 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 122.849 0.46 . . . . 0.0 110.142 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 56.0 Cg_endo -66.98 156.97 63.92 Favored 'Trans proline' 0 C--N 1.371 1.747 0 C-N-CA 122.911 2.407 . . . . 0.0 112.12 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.401 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -56.52 -31.32 63.99 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.852 0.861 . . . . 0.0 113.1 -176.779 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.66 -28.21 68.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.258 1.023 . . . . 0.0 111.736 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.441 ' OD1' ' HB3' ' B' ' 8' ' ' ARG . 57.0 t30 -89.47 -15.23 33.56 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.463 1.105 . . . . 0.0 111.082 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.577 HD22 HD11 ' A' ' 22' ' ' LEU . 28.5 mt -79.04 130.3 35.37 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.099 0.56 . . . . 0.0 110.961 -173.735 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -105.6 12.53 31.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.891 0.877 . . . . 0.0 109.763 175.314 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.5 p -113.16 90.3 16.07 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.234 1.014 . . . . 0.0 109.166 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.51 -29.53 1.81 Allowed 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.607 2.205 . . . . 0.0 112.958 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.92 -29.34 61.99 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.481 0.712 . . . . 0.0 111.122 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.427 ' HB3' HG23 ' A' ' 8' ' ' VAL . 32.6 mt -68.37 -30.09 68.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.528 0.331 . . . . 0.0 111.605 175.404 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.409 HD11 ' CD1' ' A' ' 40' ' ' LEU . 47.8 mm -71.71 -47.83 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.362 0.414 . . . . 0.0 110.343 176.405 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -54.96 -50.2 69.5 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.819 0.699 . . . . 0.0 110.386 174.756 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.36 -50.71 72.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.763 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -55.85 -50.86 69.43 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.254 1.022 . . . . 0.0 111.756 -178.425 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.43 -47.5 78.89 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.606 0.762 . . . . 0.0 111.128 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -66.16 -23.17 66.42 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.577 0.751 . . . . 0.0 111.524 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 N--CA 1.477 0.877 0 C-N-CA 123.374 0.67 . . . . 0.0 112.482 -178.922 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 21.8 p -134.51 169.83 16.68 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.75 0.82 . . . . 0.0 110.738 -170.517 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -168.26 165.39 13.04 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.864 0.866 . . . . 0.0 109.583 173.795 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.441 ' HB3' ' OD1' ' A' ' 39' ' ' ASN . 38.4 ttm-85 . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 3' ' ' PHE . . . . . 0.44 ' HD2' ' HA ' ' B' ' 8' ' ' ARG . 67.4 m-85 . . . . . 0 C--O 1.244 0.775 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 . . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.29 115.54 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.04 -177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.559 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.1 p -98.57 130.66 47.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 124.212 1.005 . . . . 0.0 109.292 171.976 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.83 -62.38 1.9 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.628 0.771 . . . . 0.0 109.912 173.427 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -165.71 168.88 15.75 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.458 0.646 . . . . 0.0 110.943 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.405 HG13 ' HB3' ' A' ' 20' ' ' TYR . 77.8 t -74.1 136.23 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.056 170.582 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.9 mt -103.0 -36.18 8.28 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.41 0.684 . . . . 0.0 110.201 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -156.12 162.74 40.2 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.27 -173.887 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -124.13 143.94 50.19 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.573 1.149 . . . . 0.0 109.344 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -137.78 164.76 28.11 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.728 0.811 . . . . 0.0 109.588 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.486 HG22 HG22 ' A' ' 18' ' ' VAL . 59.2 t -123.8 106.13 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 169.186 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.3 t -85.62 102.92 11.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 172.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 68.22 -76.08 0.06 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.257 1.423 . . . . 0.0 110.813 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.51 -10.29 0.82 Allowed Glycine 0 N--CA 1.477 1.409 0 C-N-CA 123.401 0.524 . . . . 0.0 112.833 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.566 ' HD2' ' HB3' ' A' ' 36' ' ' PRO . 18.7 ttpt -95.83 146.08 24.84 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.978 1.311 . . . . 0.0 109.319 -179.208 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.486 HG22 HG22 ' A' ' 13' ' ' VAL . 85.9 t -98.5 129.35 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.843 0.857 . . . . 0.0 109.822 177.587 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 33.9 mt-10 -121.07 148.05 44.69 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.842 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.405 ' HB3' HG13 ' A' ' 8' ' ' VAL . 88.5 m-85 -116.96 135.82 53.41 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.138 0.975 . . . . 0.0 109.551 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -78.64 106.78 10.86 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.525 HD11 HD22 ' A' ' 40' ' ' LEU . 27.0 mt -92.73 115.55 28.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.57 -173.352 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -76.73 108.94 10.11 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 166.112 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.559 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 81.4 m95 -75.17 123.44 25.26 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.444 0.465 . . . . 0.0 109.818 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -63.76 -48.34 77.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.946 0.898 . . . . 0.0 111.72 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.06 2.5 88.25 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.292 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.545 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 76.9 m-85 -128.69 171.18 12.44 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.965 0.906 . . . . 0.0 109.879 -176.509 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 82.2 p -80.55 166.12 21.46 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -174.288 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -68.64 -27.95 66.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.098 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.2 -16.66 64.07 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.585 0.754 . . . . 0.0 111.256 174.35 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.24 -1.29 21.94 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.739 0.815 . . . . 0.0 111.208 -175.407 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -58.81 126.33 27.2 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.328 0.651 . . . . 0.0 111.351 175.502 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.4 p -129.06 150.63 50.37 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.049 0.54 . . . . 0.0 111.377 -174.831 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -76.94 118.25 19.33 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.792 0.837 . . . . 0.0 109.978 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -119.8 135.78 24.43 Favored Pre-proline 0 N--CA 1.471 0.593 0 C-N-CA 122.645 0.378 . . . . 0.0 110.249 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.566 ' HB3' ' HD2' ' A' ' 17' ' ' LYS . 37.1 Cg_endo -64.71 159.57 44.61 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.7 2.267 . . . . 0.0 113.667 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -54.69 -37.2 65.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.114 1.366 . . . . 0.0 111.858 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.402 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 15.9 pt-20 -72.98 -22.14 60.74 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.836 1.254 . . . . 0.0 111.602 -177.379 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.413 ' HB2' ' HG2' ' A' ' 36' ' ' PRO . 50.2 t30 -90.79 -17.72 26.15 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 124.327 1.051 . . . . 0.0 110.825 -175.763 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.525 HD22 HD11 ' A' ' 22' ' ' LEU . 11.1 mt -76.84 129.88 36.85 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.117 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -104.82 17.67 23.7 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 170.047 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.416 ' SG ' ' HB3' ' A' ' 40' ' ' LEU . 10.8 p -116.71 90.03 30.28 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.601 1.16 . . . . 0.0 109.629 -175.728 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -80.71 -27.49 3.19 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 122.748 2.299 . . . . 0.0 112.857 -178.765 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -27.79 61.71 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.39 0.676 . . . . 0.0 110.366 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.491 HD21 ' HG2' ' B' ' 5' ' ' GLN . 34.5 mt -71.73 -40.01 69.72 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.268 0.355 . . . . 0.0 111.088 174.147 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.51 -43.61 98.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.87 -45.96 80.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.598 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.32 -31.8 73.12 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.144 -176.523 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -62.1 -47.87 82.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.638 0.775 . . . . 0.0 110.167 175.793 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 98.7 mt -62.34 -45.95 90.88 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.3 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -68.15 -24.88 65.04 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.386 0.674 . . . . 0.0 111.327 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 N--CA 1.476 0.827 0 C-N-CA 123.072 0.549 . . . . 0.0 110.664 -176.978 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.526 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.47 0.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 . . . . . . . . . 2 2 . 1 . 012 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 4.2 t -85.77 138.67 31.92 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.978 0.894 . . . . 0.0 112.577 -168.318 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -154.45 160.12 41.43 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 124.819 1.247 . . . . 0.0 108.166 170.192 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.44 ' HA ' ' HD2' ' A' ' 3' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--O 1.243 0.756 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.092 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 . . . . . 0 N--CA 1.481 1.112 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.49 134.68 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-O 120.846 0.355 . . . . 0.0 110.063 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.429 HG21 HD22 ' A' ' 22' ' ' LEU . 2.3 p -116.09 132.9 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.935 0.894 . . . . 0.0 109.966 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -63.51 -57.73 9.27 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.388 1.075 . . . . 0.0 109.351 174.915 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -171.88 168.44 6.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.116 0.966 . . . . 0.0 111.031 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.425 HG11 ' HD1' ' A' ' 20' ' ' TYR . 58.5 t -79.11 144.23 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 123.591 0.756 . . . . 0.0 109.482 172.095 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.6 mt -108.45 -43.34 4.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.286 1.034 . . . . 0.0 111.097 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.65 164.75 35.32 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.171 0.589 . . . . 0.0 110.081 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -129.74 144.52 51.33 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.234 1.014 . . . . 0.0 110.145 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -141.41 167.26 22.59 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.393 1.077 . . . . 0.0 109.953 176.235 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.1 t -126.4 108.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 168.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.27 126.46 61.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 66.55 -71.7 0.09 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.004 1.321 . . . . 0.0 111.123 -174.065 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.85 15.96 0.1 OUTLIER Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.914 176.297 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt -118.33 159.42 23.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.694 0.797 . . . . 0.0 109.711 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.8 t -101.29 118.84 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 123.237 0.615 . . . . 0.0 110.351 -179.25 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.713 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 38.8 mt-10 -104.88 161.25 14.35 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 121.604 0.716 . . . . 0.0 111.885 169.819 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.425 ' HD1' HG11 ' A' ' 8' ' ' VAL . 97.0 m-85 -135.69 128.17 30.51 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.036 1.334 . . . . 0.0 108.793 -177.678 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -77.67 107.24 10.02 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.435 HD11 HD22 ' A' ' 40' ' ' LEU . 18.6 mt -91.17 122.38 33.76 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 122.38 0.272 . . . . 0.0 111.217 -172.528 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -77.26 103.36 7.15 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 164.139 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 94.1 m95 -73.04 139.77 46.8 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 122.613 0.365 . . . . 0.0 110.497 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -90.57 120.14 31.41 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.556 0.742 . . . . 0.0 109.173 -175.77 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.28 -35.23 4.71 Favored Glycine 0 N--CA 1.472 1.1 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 -175.952 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.491 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 65.2 m-85 -80.74 162.31 24.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.108 0.963 . . . . 0.0 109.851 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.4 p -82.38 173.09 12.36 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.849 0.46 . . . . 0.0 110.923 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.21 -16.84 62.53 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.97 0.508 . . . . 0.0 111.686 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.86 -19.66 60.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.412 0.685 . . . . 0.0 111.107 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -88.16 -19.1 27.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.328 0.651 . . . . 0.0 111.54 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -52.76 121.72 7.76 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 123.718 0.636 . . . . 0.0 111.774 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.41 158.47 44.34 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.83 0.852 . . . . 0.0 110.996 -172.859 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.48 109.74 16.98 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.752 0.821 . . . . 0.0 110.63 -178.63 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -112.39 124.66 31.53 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.144 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.713 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 27.7 Cg_endo -63.18 161.94 28.39 Favored 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.772 2.315 . . . . 0.0 112.589 175.7 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -29.36 35.15 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.426 1.09 . . . . 0.0 112.42 178.672 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.474 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.5 pt-20 -67.2 -31.34 71.65 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.068 0.947 . . . . 0.0 111.044 178.796 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -80.31 -30.18 38.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.927 0.891 . . . . 0.0 111.114 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.435 HD22 HD11 ' A' ' 22' ' ' LEU . 13.5 mt -73.14 116.06 13.22 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.556 0.342 . . . . 0.0 110.325 -174.707 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -87.22 -7.57 57.77 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' B' ' 5' ' ' GLN . 12.7 p -92.81 98.81 2.44 Favored Pre-proline 0 C--N 1.354 0.777 0 C-N-CA 125.034 1.334 . . . . 0.0 110.8 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.36 -26.51 8.76 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.21 1.94 . . . . 0.0 111.546 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -77.88 -30.3 50.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.875 1.27 . . . . 0.0 111.606 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 59.5 mt -77.16 -27.4 53.75 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.522 0.329 . . . . 0.0 111.359 177.176 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.418 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 58.1 mt -68.2 -53.05 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 172.13 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.05 -51.89 68.09 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.406 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -42.26 91.22 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 124.041 0.838 . . . . 0.0 111.362 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -60.07 -48.37 82.01 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 0.0 110.942 175.984 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 72.9 mt -65.81 -25.9 67.44 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.35 0.66 . . . . 0.0 111.218 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -80.44 -27.18 38.02 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.567 0.747 . . . . 0.0 111.592 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 121.457 0.646 . . . . 0.0 109.974 -179.135 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.507 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 5.8 tp60 . . . . . 0 N--CA 1.472 0.66 0 CA-C-O 120.925 0.393 . . . . 0.0 110.065 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.406 ' H ' ' HG3' ' B' ' 5' ' ' GLN . 11.5 t -100.7 177.22 5.06 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 122.333 1.063 . . . . 0.0 111.341 -176.684 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.24 163.89 39.08 Favored 'General case' 0 C--O 1.247 0.969 0 C-N-CA 125.566 1.546 . . . . 0.0 107.785 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 . . . . . 0 C--N 1.323 -0.569 0 C-N-CA 124.396 1.078 . . . . 0.0 108.47 -172.637 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 . . . . . 0 N--CA 1.472 0.637 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.8 m -83.22 136.41 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 122.74 0.416 . . . . 0.0 110.1 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.457 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -117.25 129.68 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.935 0.894 . . . . 0.0 110.185 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -70.37 -56.69 6.07 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 124.464 1.106 . . . . 0.0 110.616 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -155.07 161.16 41.38 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.735 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.402 HG23 ' HB3' ' A' ' 45' ' ' LEU . 61.7 t -88.29 136.14 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-N 115.323 -0.853 . . . . 0.0 108.802 168.859 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -102.8 -50.7 3.47 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 110.696 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -150.75 168.09 25.45 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.283 0.633 . . . . 0.0 110.316 -169.822 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -134.2 142.81 47.53 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.543 1.137 . . . . 0.0 111.36 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -134.71 168.88 18.21 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.143 1.377 . . . . 0.0 108.756 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.92 110.78 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.43 0.692 . . . . 0.0 109.347 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 64.3 t -106.47 107.44 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.381 1.072 . . . . 0.0 110.066 176.54 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 57.24 43.31 23.93 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.77 1.228 . . . . 0.0 112.291 170.41 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.39 -25.2 23.84 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 115.614 -0.721 . . . . 0.0 113.226 177.948 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -91.24 151.45 20.92 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.102 0.961 . . . . 0.0 109.727 179.037 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.8 t -98.03 138.31 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.65 0.78 . . . . 0.0 109.743 177.589 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.608 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.2 mt-10 -121.28 166.48 13.96 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 167.017 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -137.1 152.52 50.1 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.576 1.15 . . . . 0.0 108.836 -177.573 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -92.5 109.28 20.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.512 HD11 HD21 ' A' ' 40' ' ' LEU . 10.4 mp -92.05 116.52 29.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.109 0.564 . . . . 0.0 110.844 -174.072 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tmtm? -76.36 99.66 4.91 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 105.695 -1.965 . . . . 0.0 105.695 165.738 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.655 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 94.2 m95 -70.16 135.17 48.87 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.421 0.451 . . . . 0.0 111.42 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -78.39 121.04 23.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.533 1.133 . . . . 0.0 109.923 -176.413 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.78 0.0 87.81 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 113.312 -176.966 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.468 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.8 m-85 -118.6 152.45 36.01 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.993 0.917 . . . . 0.0 110.044 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.0 t -77.66 163.66 26.0 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.401 0.68 . . . . 0.0 111.746 -173.699 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.425 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 m-20 -65.44 -31.69 72.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.752 0.821 . . . . 0.0 111.992 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.41 -18.75 65.23 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.502 0.721 . . . . 0.0 111.79 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -108.56 -5.64 16.42 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.169 0.987 . . . . 0.0 111.177 -176.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.655 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.6 m120 -66.37 132.7 48.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.582 0.353 . . . . 0.0 111.102 175.35 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 62.6 p -127.35 160.98 29.73 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.46 0.704 . . . . 0.0 111.41 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -84.45 122.66 29.29 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.998 175.267 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -120.9 137.61 26.73 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 123.012 0.525 . . . . 0.0 110.61 175.642 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.608 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 32.2 Cg_endo -64.05 161.54 33.03 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 122.397 2.065 . . . . 0.0 112.084 173.743 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -24.32 66.33 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.8 179.591 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.457 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 17.1 pt-20 -73.98 -22.44 59.62 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.732 0.813 . . . . 0.0 111.441 178.653 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -87.42 -15.94 36.3 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.423 0.689 . . . . 0.0 111.372 177.089 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.512 HD21 HD11 ' A' ' 22' ' ' LEU . 62.5 mt -72.85 116.39 13.29 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.595 0.358 . . . . 0.0 111.2 -176.572 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 6.81 42.98 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 18.4 p -106.36 92.68 7.18 Favored Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 125.264 1.425 . . . . 0.0 110.147 -178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -38.76 0.49 Allowed 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.605 2.203 . . . . 0.0 113.599 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.25 -21.21 59.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.815 0.446 . . . . 0.0 111.646 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.419 ' HG ' ' OE1' ' B' ' 5' ' ' GLN . 74.0 mt -73.25 -30.22 63.31 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.508 0.323 . . . . 0.0 111.275 174.758 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.4 mt -66.47 -46.53 86.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.615 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -62.86 -43.53 98.55 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.925 176.147 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.42 73.74 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.15 0.58 . . . . 0.0 110.915 -176.343 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -62.04 -43.57 98.56 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.059 0.944 . . . . 0.0 110.479 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.3 mt -71.18 -29.47 65.22 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.478 0.711 . . . . 0.0 110.291 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -76.55 -15.97 59.73 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.751 0.82 . . . . 0.0 111.189 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 29.7 m . . . . . 0 N--CA 1.478 0.963 0 C-N-CA 123.276 0.631 . . . . 0.0 110.393 172.799 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.419 ' OE1' ' HG ' ' A' ' 45' ' ' LEU . 5.3 tp-100 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 121.339 0.59 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.04 176.66 7.45 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.456 -160.402 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -171.89 168.75 5.95 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.587 1.155 . . . . 0.0 109.473 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 . . . . . 0 N--CA 1.47 0.572 0 C-N-CA 124.145 0.978 . . . . 0.0 108.804 177.259 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.513 ' HA ' HG22 ' B' ' 6' ' ' THR . 7.5 p -83.35 136.41 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.306 0.574 . . . . 0.0 111.579 -173.526 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.47 HG21 HD22 ' A' ' 22' ' ' LEU . 1.5 p -118.02 126.84 75.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.253 1.021 . . . . 0.0 109.445 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.25 -51.82 68.32 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.188 1.395 . . . . 0.0 111.514 174.398 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -170.77 165.54 7.98 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.73 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.472 HG11 ' HD2' ' A' ' 20' ' ' TYR . 98.0 t -82.26 133.59 28.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.596 168.206 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.9 mt -99.98 -38.47 8.58 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.468 0.707 . . . . 0.0 110.429 -178.394 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -153.62 163.6 39.7 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.85 0.46 . . . . 0.0 110.575 -174.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.0 ttt-85 -132.57 145.06 50.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.721 1.209 . . . . 0.0 109.329 -178.787 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -144.63 163.26 34.48 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.861 0.864 . . . . 0.0 109.655 176.15 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.471 HG22 HG22 ' A' ' 18' ' ' VAL . 88.3 t -122.23 109.49 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.612 0.765 . . . . 0.0 108.941 175.375 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.2 t -113.54 115.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.649 1.179 . . . . 0.0 109.701 177.788 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 64.73 27.71 13.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.839 1.256 . . . . 0.0 112.012 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.15 -11.82 66.24 Favored Glycine 0 N--CA 1.472 1.071 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.121 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -86.3 146.42 26.51 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.471 HG22 HG22 ' A' ' 13' ' ' VAL . 98.4 t -107.16 121.92 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.32 0.648 . . . . 0.0 109.453 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 48.5 mt-10 -112.84 155.91 23.82 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.048 0.939 . . . . 0.0 109.597 177.757 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.472 ' HD2' HG11 ' A' ' 8' ' ' VAL . 96.4 m-85 -132.92 129.45 38.34 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.469 1.108 . . . . 0.0 108.711 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -76.88 107.76 9.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.47 HD22 HG21 ' A' ' 5' ' ' VAL . 16.6 mt -87.51 122.73 31.61 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.9 -175.036 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -76.24 93.17 3.36 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 165.275 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.56 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 85.6 m95 -65.22 117.61 8.05 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.137 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -70.54 -43.46 69.49 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.308 0.643 . . . . 0.0 110.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.16 13.6 64.48 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.895 -0.593 . . . . 0.0 113.784 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -136.78 161.69 35.28 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.159 0.984 . . . . 0.0 109.801 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.3 p -68.24 159.74 30.62 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.756 0.822 . . . . 0.0 111.795 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.51 -38.27 89.19 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.055 -174.512 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.66 -19.86 65.96 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.341 0.657 . . . . 0.0 111.877 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -96.43 -2.11 46.11 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 123.933 0.893 . . . . 0.0 110.868 -178.733 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.56 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 1.5 m120 -64.94 129.08 38.42 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.631 0.773 . . . . 0.0 110.394 172.5 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 p -138.64 158.72 43.72 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.305 0.642 . . . . 0.0 112.01 -169.564 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -80.79 121.07 25.47 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.636 1.174 . . . . 0.0 111.147 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.487 ' HB2' HD21 ' A' ' 40' ' ' LEU . 49.3 mm-40 -122.59 134.01 24.72 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 123.425 0.69 . . . . 0.0 110.552 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 69.7 Cg_endo -70.6 154.86 64.15 Favored 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.778 2.319 . . . . 0.0 111.813 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.29 -28.39 62.98 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.407 1.083 . . . . 0.0 113.31 -175.327 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.92 -37.71 82.0 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.066 0.946 . . . . 0.0 110.552 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.409 HD22 ' HB3' ' A' ' 35' ' ' GLU . 41.8 t30 -77.58 -23.21 50.02 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 110.604 -178.027 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.487 HD21 ' HB2' ' A' ' 35' ' ' GLU . 57.6 mt -75.02 137.41 41.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.939 -178.456 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -111.68 11.26 21.06 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.909 0.883 . . . . 0.0 109.643 176.784 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.2 p -115.54 90.96 27.52 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 123.813 0.845 . . . . 0.0 111.059 -175.292 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.31 -24.72 14.1 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.615 2.21 . . . . 0.0 111.897 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.84 -52.74 63.9 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.779 1.232 . . . . 0.0 110.926 176.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.16 -33.68 73.78 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.144 -175.477 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.409 HD11 HD13 ' A' ' 40' ' ' LEU . 47.7 mm -68.4 -46.68 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 122.759 0.424 . . . . 0.0 110.391 178.422 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.9 -53.96 52.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.825 0.85 . . . . 0.0 110.522 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.57 -46.69 88.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.835 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -61.99 -52.41 64.11 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.067 0.947 . . . . 0.0 111.93 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.15 -33.6 73.66 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.435 0.694 . . . . 0.0 111.181 -177.634 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -75.38 -37.77 60.35 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.428 0.691 . . . . 0.0 111.491 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 61.8 m . . . . . 0 N--CA 1.486 1.36 0 C-N-CA 123.752 0.821 . . . . 0.0 112.234 -178.867 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 122.068 0.937 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.513 HG22 ' HA ' ' A' ' 4' ' ' VAL . 40.8 p -134.01 175.18 9.71 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.817 1.247 . . . . 0.0 110.135 -177.633 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.21 161.37 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.633 1.173 . . . . 0.0 109.964 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.564 ' H ' ' HD2' ' B' ' 8' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.272 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 174.351 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 66.7 t80 . . . . . 0 N--CA 1.475 0.799 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.541 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 4.2 p -69.72 126.92 30.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 CA-C-O 121.353 0.597 . . . . 0.0 112.284 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.472 HG21 HD22 ' A' ' 22' ' ' LEU . 2.1 p -99.84 120.14 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.483 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.27 -57.96 8.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.733 1.613 . . . . 0.0 111.726 174.054 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -162.52 161.88 27.16 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.52 -174.902 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.5 t -85.49 130.65 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 168.28 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.7 mt -96.91 -38.54 9.78 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.887 0.875 . . . . 0.0 111.282 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -156.24 164.33 38.48 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.117 -169.838 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.568 ' HE ' HG11 ' A' ' 18' ' ' VAL . 41.8 ttt180 -134.94 144.33 47.39 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 0.0 110.577 -173.375 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -140.49 163.62 32.34 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.791 0.836 . . . . 0.0 109.798 176.617 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 13' ' ' VAL . . . . . 0.441 HG22 HG22 ' A' ' 18' ' ' VAL . 89.2 t -121.7 123.93 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.019 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 14' ' ' VAL . . . . . 0.444 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 2.6 p -139.21 123.25 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.032 0.933 . . . . 0.0 108.884 -177.863 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 60.77 22.49 12.48 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.276 1.03 . . . . 0.0 112.455 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.31 -8.15 77.61 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.878 -0.401 . . . . 0.0 113.994 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 15.0 ptpt -94.93 171.58 8.68 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.568 HG11 ' HE ' ' A' ' 11' ' ' ARG . 99.1 t -117.69 126.3 74.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 174.89 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.581 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 36.7 mt-10 -106.82 157.09 18.01 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.576 0.703 . . . . 0.0 109.721 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -126.61 127.44 45.23 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.441 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -77.06 108.85 10.43 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.472 HD22 HG21 ' A' ' 5' ' ' VAL . 49.8 mt -81.78 172.79 12.95 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.061 0.851 . . . . 0.0 111.102 -174.648 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -126.46 100.97 6.48 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.531 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 84.6 m95 -69.57 116.63 10.19 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.754 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -73.1 114.32 11.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 123.778 0.674 . . . . 0.0 110.173 -171.599 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 118.13 -29.26 6.56 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 -174.17 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -98.05 157.81 15.91 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.214 1.005 . . . . 0.0 111.256 179.084 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' THR . . . . . 0.404 HG23 ' H ' ' A' ' 31' ' ' ASP . 9.1 t -74.26 160.77 30.66 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.598 178.714 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.475 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.7 m-20 -70.0 -19.04 63.35 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.147 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.02 -31.54 66.29 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.868 0.867 . . . . 0.0 110.578 173.308 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ASP . . . . . 0.404 ' H ' HG23 ' A' ' 28' ' ' THR . 27.7 t70 -78.79 -30.7 45.65 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.366 0.666 . . . . 0.0 110.978 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.531 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.0 m120 -61.46 148.75 40.83 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.846 0.716 . . . . 0.0 112.423 -172.746 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.3 p -126.57 163.8 22.61 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.772 0.829 . . . . 0.0 111.286 -167.779 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.3 119.73 25.41 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 170.632 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -119.56 132.71 23.92 Favored Pre-proline 0 C--O 1.239 0.511 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 172.125 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.581 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 48.2 Cg_endo -67.11 160.0 49.46 Favored 'Trans proline' 0 C--N 1.366 1.455 0 C-N-CA 122.161 1.907 . . . . 0.0 112.333 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -55.69 -28.22 54.38 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.025 1.33 . . . . 0.0 112.204 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.473 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.0 pt-20 -75.5 -17.72 60.03 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.056 1.342 . . . . 0.0 111.731 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -107.97 -4.77 17.57 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.199 0.599 . . . . 0.0 111.331 -169.636 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.567 HD12 HD11 ' A' ' 46' ' ' ILE . 30.7 mt -87.05 158.2 19.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.15 0.58 . . . . 0.0 110.861 -177.49 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.54 9.76 25.23 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 166.474 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 23.0 p -117.43 90.61 35.28 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 123.069 0.548 . . . . 0.0 111.527 -172.663 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.75 -22.14 10.63 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.314 2.01 . . . . 0.0 111.079 166.319 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.28 -44.31 83.91 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.246 1.018 . . . . 0.0 111.593 177.556 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.81 -29.18 55.87 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.982 0.513 . . . . 0.0 110.963 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.567 HD11 HD12 ' A' ' 40' ' ' LEU . 72.0 mt -63.48 -54.28 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 172.088 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.51 -46.14 89.78 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.692 -176.843 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.2 90.2 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 123.747 0.655 . . . . 0.0 110.766 -177.974 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' PHE . . . . . 0.427 ' CE2' ' HB2' ' A' ' 11' ' ' ARG . 82.8 t80 -58.78 -48.5 81.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.044 0.538 . . . . 0.0 109.952 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.3 mt -65.56 -27.6 68.55 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.498 0.719 . . . . 0.0 111.557 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -82.5 -19.64 38.35 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.582 0.753 . . . . 0.0 111.981 175.412 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.5 m . . . . . 0 N--CA 1.48 1.035 0 C-N-CA 122.691 0.396 . . . . 0.0 110.321 177.585 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.52 0.2 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 76.1 p -99.33 177.71 5.11 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.016 0.912 . . . . 0.0 112.532 -171.828 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -163.84 156.36 17.64 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.267 174.177 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 123.249 0.62 . . . . 0.0 109.673 179.779 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 . . . . . 0 C--O 1.239 0.509 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.4 p -80.53 123.82 37.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-O 121.468 0.651 . . . . 0.0 109.562 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.513 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -102.97 133.45 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.412 1.085 . . . . 0.0 109.358 175.547 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.622 ' HB2' ' HG3' ' A' ' 25' ' ' LYS . 34.3 tt0 -69.55 -49.15 57.02 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.474 0.71 . . . . 0.0 111.01 176.585 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HA ' HD22 ' A' ' 45' ' ' LEU . 21.1 ptmt -166.61 164.92 16.93 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.633 0.583 . . . . 0.0 111.607 -173.937 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.537 HG11 ' HD2' ' A' ' 20' ' ' TYR . 94.7 t -85.51 135.76 24.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.475 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.0 mt -100.48 -43.64 6.15 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.736 0.814 . . . . 0.0 110.137 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -148.92 164.86 33.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.343 -171.076 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.507 ' HE ' HG11 ' A' ' 18' ' ' VAL . 34.9 ttt180 -138.72 128.59 25.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.068 0.947 . . . . 0.0 109.485 -175.878 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 12' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 12' ' ' ARG . 3.0 ptm180 -124.41 162.31 24.15 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.934 0.894 . . . . 0.0 109.35 175.987 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -126.31 112.45 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.966 0.906 . . . . 0.0 108.768 177.63 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.0 m -120.45 125.2 73.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.113 0.965 . . . . 0.0 109.401 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 61.61 20.84 11.63 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.226 1.01 . . . . 0.0 112.108 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.8 -24.04 32.76 Favored Glycine 0 C--N 1.348 1.211 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.448 -176.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.8 ptmt -82.54 163.35 21.58 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.507 HG11 ' HE ' ' A' ' 11' ' ' ARG . 45.9 t -117.6 127.11 75.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 123.312 0.645 . . . . 0.0 110.186 -176.382 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.569 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 45.1 mt-10 -109.19 154.05 22.92 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.599 0.76 . . . . 0.0 109.586 170.504 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.537 ' HD2' HG11 ' A' ' 8' ' ' VAL . 63.8 m-85 -128.04 128.51 45.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.435 1.094 . . . . 0.0 108.669 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -78.51 107.89 11.49 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.2 mt -92.84 119.86 32.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.345 -171.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -75.87 93.33 3.18 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 167.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.626 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 87.1 m95 -68.51 134.79 50.6 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 178.483 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.622 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 26.4 mttm -67.64 134.23 50.79 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.863 0.727 . . . . 0.0 110.19 172.537 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.19 -33.95 4.12 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.842 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.427 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 79.7 m-85 -91.43 149.48 21.69 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.048 0.939 . . . . 0.0 110.509 -177.146 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 p -70.54 160.98 31.47 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.934 0.894 . . . . 0.0 111.795 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' ASP . . . . . 0.472 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 p-10 -65.54 -29.94 70.62 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.341 1.057 . . . . 0.0 111.872 -177.406 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.8 -27.02 57.78 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.541 0.736 . . . . 0.0 111.19 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -89.04 -11.96 42.67 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.65 0.78 . . . . 0.0 110.83 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.626 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -64.26 143.07 58.16 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 122.529 0.332 . . . . 0.0 110.479 174.668 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 34.2 p -132.94 160.85 35.87 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.191 0.596 . . . . 0.0 111.876 -168.427 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -82.24 122.23 27.65 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.78 173.873 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -121.08 130.18 24.96 Favored Pre-proline 0 C--O 1.239 0.533 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 171.989 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.569 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 23.6 Cg_endo -61.22 162.04 21.19 Favored 'Trans proline' 0 C--N 1.371 1.758 0 C-N-CA 122.339 2.026 . . . . 0.0 112.31 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -55.02 -26.32 36.42 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 125.555 1.542 . . . . 0.0 113.153 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -77.65 -28.22 51.2 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.825 1.25 . . . . 0.0 111.989 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.6 m-20 -77.63 -21.87 51.62 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.525 0.73 . . . . 0.0 111.517 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.0 mt -73.28 117.48 15.07 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 122.886 0.474 . . . . 0.0 110.412 -176.624 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -94.78 -3.84 48.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.391 0.676 . . . . 0.0 110.204 172.382 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 16.3 p -101.01 98.0 7.91 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.618 1.167 . . . . 0.0 110.893 -176.08 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -76.22 -25.19 10.27 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.623 2.215 . . . . 0.0 112.191 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -59.3 -47.99 83.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.549 1.14 . . . . 0.0 110.916 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 7' ' ' LYS . 91.7 mt -70.36 -34.49 72.67 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.656 -177.084 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.6 mt -66.0 -51.01 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.88 -51.41 69.81 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.932 0.893 . . . . 0.0 111.025 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.93 79.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.565 0.746 . . . . 0.0 112.23 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -71.77 -54.44 10.22 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 122.722 0.409 . . . . 0.0 110.489 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.94 -37.68 79.01 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.516 0.726 . . . . 0.0 112.208 -171.112 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -81.55 -16.77 50.67 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.682 0.393 . . . . 0.0 111.564 -177.238 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.478 0.949 0 C-N-CA 122.528 0.331 . . . . 0.0 110.824 175.723 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 . . . . . 0 CA--C 1.53 0.179 0 CA-C-O 121.782 0.801 . . . . 0.0 109.187 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.6 m -104.44 153.47 21.07 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 113.885 -1.507 . . . . 0.0 108.971 -176.649 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.09 140.24 17.5 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.383 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 15.1 ttt85 . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.637 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 83.5 t80 . . . . . 0 N--CA 1.473 0.698 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 4' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 3.7 p -69.61 109.84 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.96 0.886 . . . . 0.0 111.193 176.226 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.473 HG21 HD22 ' A' ' 22' ' ' LEU . 1.7 p -76.85 140.5 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.223 171.082 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' GLU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 35.1 tt0 -68.31 -59.51 3.14 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.408 0.683 . . . . 0.0 110.162 176.356 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -166.41 164.87 17.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.598 -176.293 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.458 HG23 ' HB3' ' A' ' 45' ' ' LEU . 91.6 t -83.72 137.3 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.089 0.955 . . . . 0.0 108.969 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.5 mt -110.01 -29.58 8.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.354 0.661 . . . . 0.0 110.805 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -160.31 165.33 31.5 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.691 0.396 . . . . 0.0 110.65 -173.306 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.2 ttt180 -139.01 134.86 33.61 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.109 1.364 . . . . 0.0 109.754 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -134.04 175.69 9.25 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.534 1.134 . . . . 0.0 109.493 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -125.23 114.67 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.594 0.758 . . . . 0.0 109.654 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 73.3 t -126.85 131.76 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 173.558 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 70.63 14.52 7.2 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.714 1.259 . . . . 0.0 110.924 -177.315 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.0 9.29 86.84 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 116.184 -0.462 . . . . 0.0 113.074 -173.688 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.25 155.54 23.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 56.2 t -96.4 119.98 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.72 0.808 . . . . 0.0 109.632 -171.284 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.644 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.6 mt-10 -119.56 138.5 53.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.417 0.687 . . . . 0.0 110.017 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -113.93 132.33 55.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.1 0.96 . . . . 0.0 110.25 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -78.12 107.82 10.97 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.473 HD22 HG21 ' A' ' 5' ' ' VAL . 39.9 mt -97.74 122.41 40.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.352 -171.249 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.5 tmtt? -79.89 113.69 18.24 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 161.169 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.7 m95 -82.75 139.02 33.84 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.119 0.568 . . . . 0.0 110.005 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LYS . . . . . 0.522 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 59.2 tttp -62.67 -59.2 5.23 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.563 0.745 . . . . 0.0 112.009 -166.76 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.29 29.07 6.28 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 113.649 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.552 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 88.7 m-85 -135.69 167.37 21.27 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.407 1.083 . . . . 0.0 109.836 174.925 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.4 p -82.8 171.81 13.54 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.509 0.724 . . . . 0.0 111.869 -175.507 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -70.26 -30.23 67.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.604 0.762 . . . . 0.0 110.98 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.85 60.64 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.546 0.738 . . . . 0.0 111.101 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -94.59 10.89 33.02 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.396 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.8 142.83 57.22 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.095 0.958 . . . . 0.0 111.662 174.848 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.9 p -141.33 155.61 45.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.609 0.764 . . . . 0.0 110.976 -176.031 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -87.29 111.26 20.87 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.787 0.835 . . . . 0.0 110.912 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -117.73 126.96 26.95 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.644 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.9 Cg_endo -67.01 157.22 62.8 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 122.497 2.131 . . . . 0.0 112.886 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -30.63 61.71 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.575 1.15 . . . . 0.0 112.885 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -67.43 -33.89 76.09 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.642 0.734 . . . . 0.0 110.346 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' ASN . . . . . 0.404 ' OD1' ' HB3' ' B' ' 8' ' ' ARG . 60.1 t30 -89.5 -18.92 25.75 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.854 1.262 . . . . 0.0 110.833 -175.229 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.566 HD12 HD11 ' A' ' 46' ' ' ILE . 23.3 mt -70.51 162.73 28.26 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.784 0.434 . . . . 0.0 110.655 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -137.07 34.21 2.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 24.4 p -147.76 95.01 4.29 Favored Pre-proline 0 C--N 1.355 0.818 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.497 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.86 -16.11 18.54 Favored 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.234 1.956 . . . . 0.0 111.323 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -60.5 -43.8 96.65 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.457 1.103 . . . . 0.0 111.218 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' LEU . . . . . 0.468 HD21 ' HG3' ' B' ' 5' ' ' GLN . 69.6 mt -72.95 -44.59 60.97 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.865 0.466 . . . . 0.0 111.787 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.566 HD11 HD12 ' A' ' 40' ' ' LEU . 63.4 mt -60.94 -45.16 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 123.819 0.699 . . . . 0.0 110.536 -176.783 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.51 -52.99 58.85 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.339 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.32 -32.5 66.77 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.696 0.798 . . . . 0.0 112.216 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -67.29 -42.95 82.91 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.647 1.179 . . . . 0.0 110.684 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 90.2 mt -75.84 -32.34 59.74 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.162 0.585 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -74.42 -26.68 60.22 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.277 1.031 . . . . 0.0 110.271 -179.192 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 123.842 0.857 . . . . 0.0 110.293 173.345 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.779 ' N ' HE21 ' B' ' 5' ' ' GLN . 0.0 OUTLIER . . . . . 0 CA--C 1.551 1.001 0 CA-C-O 121.901 0.858 . . . . 0.0 109.373 . . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 6' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 14.8 p -113.29 169.39 8.98 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.173 0.989 . . . . 0.0 111.133 -175.988 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.47 159.28 19.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 123.79 0.836 . . . . 0.0 109.176 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' B' B ' 8' ' ' ARG . . . . . 0.404 ' HB3' ' OD1' ' A' ' 39' ' ' ASN . 32.8 ttm-85 . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -175.95 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 . . . . . 0 N--CA 1.47 0.566 0 CA-C-O 121.412 0.625 . . . . 0.0 109.377 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.2 p -83.81 135.91 23.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.607 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' VAL . . . . . 0.507 HG21 ' HG ' ' A' ' 22' ' ' LEU . 1.5 p -112.99 130.7 66.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.77 -63.87 1.01 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.252 1.021 . . . . 0.0 110.171 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -165.05 169.68 16.0 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.767 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.593 HG11 ' HD2' ' A' ' 20' ' ' TYR . 99.8 t -83.08 144.64 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.815 171.631 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.44 -31.63 7.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.754 0.822 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -154.23 161.84 41.56 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -176.047 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 11' ' ' ARG . . . . . 0.411 HH21 HG11 ' A' ' 18' ' ' VAL . 47.9 ttt180 -133.76 141.37 47.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.471 0.708 . . . . 0.0 109.223 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -148.25 171.43 15.97 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.955 0.502 . . . . 0.0 110.4 178.33 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -119.79 120.82 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 123.76 0.824 . . . . 0.0 109.216 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.1 t -131.62 126.49 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.21 1.004 . . . . 0.0 108.703 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.5 m120 67.23 18.06 10.31 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.938 1.295 . . . . 0.0 111.267 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.56 -18.05 48.66 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.561 -172.881 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -78.26 162.71 26.34 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.622 0.769 . . . . 0.0 110.128 -177.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 18' ' ' VAL . . . . . 0.411 HG11 HH21 ' A' ' 11' ' ' ARG . 82.4 t -107.81 106.93 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 0.0 109.391 -175.413 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.562 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 89.8 mt-10 -105.14 152.86 22.29 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.327 0.651 . . . . 0.0 111.225 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.593 ' HD2' HG11 ' A' ' 8' ' ' VAL . 92.3 m-85 -132.53 136.5 46.67 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.074 1.35 . . . . 0.0 107.777 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -79.59 105.77 11.14 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 174.434 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.548 HD21 HD22 ' A' ' 40' ' ' LEU . 10.2 mp -86.88 113.53 22.75 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.398 0.679 . . . . 0.0 110.777 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtm? -72.84 97.65 2.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 168.114 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.575 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 83.6 m95 -65.1 123.43 19.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 174.808 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -64.95 115.49 5.43 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.398 1.061 . . . . 0.0 110.612 -172.905 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.08 -4.05 67.39 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 115.667 -0.697 . . . . 0.0 113.475 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.424 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 96.4 m-85 -109.7 142.25 41.15 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.964 0.905 . . . . 0.0 110.073 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 t -62.37 152.45 34.0 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.775 0.83 . . . . 0.0 111.643 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.84 -23.28 64.23 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.903 0.881 . . . . 0.0 112.747 -172.341 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.82 -31.16 64.6 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.902 0.481 . . . . 0.0 110.634 173.097 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -80.08 -30.2 39.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.706 0.802 . . . . 0.0 111.196 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.575 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -61.46 143.36 56.02 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.215 0.606 . . . . 0.0 111.195 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.9 p -126.97 169.28 13.48 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.206 0.602 . . . . 0.0 112.268 -164.093 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -88.25 114.66 25.09 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.743 0.817 . . . . 0.0 109.854 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.471 ' HB2' HD13 ' A' ' 22' ' ' LEU . 72.8 mm-40 -117.98 131.45 24.15 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 123.441 0.696 . . . . 0.0 109.766 173.759 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.562 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 67.8 Cg_endo -72.09 153.93 57.38 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 122.188 1.925 . . . . 0.0 112.18 174.489 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -30.68 63.37 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.192 0.997 . . . . 0.0 112.178 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.527 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 16.2 pt-20 -70.8 -8.81 55.17 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.397 1.079 . . . . 0.0 111.477 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -115.6 -7.28 12.19 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.159 0.983 . . . . 0.0 110.72 -174.942 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.548 HD22 HD21 ' A' ' 22' ' ' LEU . 14.1 mt -86.73 143.09 27.71 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.036 0.534 . . . . 0.0 112.04 -175.837 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -93.12 -6.45 47.97 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.048 0.539 . . . . 0.0 110.305 172.013 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 42' ' ' CYS . . . . . 0.548 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 21.2 p -107.15 98.47 22.4 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -175.908 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.9 -27.35 8.69 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.339 2.026 . . . . 0.0 111.666 173.407 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -61.21 -47.12 87.6 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 123.766 0.827 . . . . 0.0 111.154 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.13 -29.65 65.51 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.26 0.624 . . . . 0.0 111.762 -175.5 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.402 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 72.6 mt -66.19 -54.12 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.566 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -54.56 -53.51 53.52 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.326 1.05 . . . . 0.0 109.671 176.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -33.09 74.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.792 -168.106 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -65.86 -50.38 64.78 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.437 0.461 . . . . 0.0 110.246 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 72.6 mt -62.92 -32.13 73.35 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.841 0.713 . . . . 0.0 110.247 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -71.31 -39.33 71.51 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.825 1.25 . . . . 0.0 109.463 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.471 0.614 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.299 -177.743 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' B' B ' 5' ' ' GLN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 2.2 mp0 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 121.47 0.652 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 35.4 p -142.67 176.31 9.14 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 124.041 0.937 . . . . 0.0 109.338 178.885 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -166.26 174.4 9.2 Favored 'General case' 0 C--O 1.261 1.686 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.112 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 . . . . . 0 C--O 1.237 0.399 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -178.07 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 . . . . . 0 C--O 1.239 0.518 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.7 p -74.64 125.47 34.11 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.397 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.3 p -107.19 134.92 47.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.642 -177.025 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.95 -58.15 5.52 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.543 1.137 . . . . 0.0 110.547 177.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -164.17 167.24 20.34 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.883 -170.296 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' VAL . . . . . 0.439 HG13 ' HB3' ' A' ' 20' ' ' TYR . 65.2 t -94.18 141.5 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 169.008 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.4 mt -109.44 -38.39 5.48 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.076 0.95 . . . . 0.0 111.075 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -157.85 164.39 37.0 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.921 0.489 . . . . 0.0 110.218 -172.597 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -130.88 138.83 49.99 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.657 1.183 . . . . 0.0 110.045 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -132.88 163.04 30.01 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.281 1.032 . . . . 0.0 109.102 174.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.0 t -130.87 109.07 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 171.238 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 m -118.78 125.2 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.192 0.997 . . . . 0.0 110.6 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 58.51 25.99 13.75 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.658 1.183 . . . . 0.0 112.281 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.02 -16.87 58.53 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.286 -178.269 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' LYS . . . . . 0.406 ' HD2' ' HB3' ' A' ' 36' ' ' PRO . 6.3 ttpp -84.04 149.64 26.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.048 0.939 . . . . 0.0 109.42 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.8 t -115.98 114.44 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.82 0.848 . . . . 0.0 109.307 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' GLU . . . . . 0.663 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 40.4 mt-10 -110.43 155.23 22.49 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.154 0.502 . . . . 0.0 110.708 -179.284 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HB3' HG13 ' A' ' 8' ' ' VAL . 96.7 m-85 -128.36 130.23 47.42 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.246 1.018 . . . . 0.0 109.059 -177.924 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.67 107.39 11.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 22' ' ' LEU . . . . . 0.477 HD11 HD22 ' A' ' 40' ' ' LEU . 39.1 mt -95.87 129.48 43.11 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 122.843 0.457 . . . . 0.0 111.083 -171.898 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 23' ' ' LYS . . . . . 0.471 ' HG2' HD21 ' A' ' 32' ' ' ASN . 5.7 tmtm? -84.02 115.54 22.4 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 162.862 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' TRP . . . . . 0.553 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 82.1 m95 -79.71 130.37 35.29 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.725 0.41 . . . . 0.0 109.959 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -67.76 -46.13 72.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.188 0.595 . . . . 0.0 111.792 -167.96 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.17 20.36 50.48 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.409 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 86.6 m-85 -140.0 171.27 14.43 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.761 0.824 . . . . 0.0 111.152 -176.935 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.1 p -80.47 172.02 14.3 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.961 0.904 . . . . 0.0 112.777 -174.691 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.67 -27.67 63.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.434 1.094 . . . . 0.0 111.445 176.355 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.05 -22.72 62.09 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.207 0.603 . . . . 0.0 110.953 175.079 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -85.34 -20.15 30.39 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.283 1.033 . . . . 0.0 110.927 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' ASN . . . . . 0.471 HD21 ' HG2' ' A' ' 23' ' ' LYS . 11.0 m-20 -48.87 121.69 4.95 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.364 1.066 . . . . 0.0 111.643 176.155 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.46 158.13 45.16 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.268 0.627 . . . . 0.0 112.003 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -81.4 113.09 19.25 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.568 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' GLU . . . . . 0.471 ' HB2' HD21 ' A' ' 40' ' ' LEU . 46.3 mm-40 -117.43 129.07 25.59 Favored Pre-proline 0 CA--C 1.544 0.714 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.323 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 36' ' ' PRO . . . . . 0.663 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.6 Cg_endo -66.57 159.0 52.86 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 122.526 2.151 . . . . 0.0 113.287 177.058 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 37' ' ' GLU . . . . . 0.425 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -63.19 -28.31 69.96 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.654 0.781 . . . . 0.0 112.323 -177.532 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 38' ' ' GLU . . . . . 0.529 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.0 pt-20 -68.36 -20.68 64.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.156 0.982 . . . . 0.0 111.27 175.186 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -103.91 -7.17 20.64 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.618 1.167 . . . . 0.0 110.293 -175.056 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.477 HD22 HD11 ' A' ' 22' ' ' LEU . 18.5 mt -89.51 137.31 32.44 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.206 0.602 . . . . 0.0 110.838 178.433 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -100.07 -3.01 32.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.39 0.676 . . . . 0.0 109.438 170.495 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.7 p -106.57 91.75 6.35 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.141 0.976 . . . . 0.0 110.618 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.31 -14.28 4.89 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.423 2.082 . . . . 0.0 112.501 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -70.44 -44.11 68.5 Favored 'General case' 0 C--O 1.215 -0.744 0 C-N-CA 123.825 0.85 . . . . 0.0 109.843 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.21 -33.59 76.37 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.509 0.724 . . . . 0.0 111.01 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 75.2 mt -64.41 -55.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 174.173 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.26 -45.49 80.06 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.091 0.956 . . . . 0.0 111.326 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.11 -42.39 99.17 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.237 1.015 . . . . 0.0 110.802 -177.476 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -60.31 -50.48 73.46 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.694 174.577 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 81.5 mt -62.06 -36.49 81.8 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.802 0.841 . . . . 0.0 111.255 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -74.32 -40.09 62.44 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 110.39 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.0 m . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 123.342 0.657 . . . . 0.0 112.563 -178.533 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 . . . . . 0 C--O 1.243 0.755 0 CA-C-O 121.934 0.873 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 36.3 p -126.28 177.56 6.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.321 -1.308 . . . . 0.0 109.861 -177.039 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.93 171.83 16.17 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.134 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 . . . . . 0 C--N 1.319 -0.75 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 -174.015 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.442 0 N-CA-C 112.218 -0.353 . . . . 0.0 112.218 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -100.67 108.74 20.68 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 174.207 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -106.62 147.66 29.24 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.346 0.658 . . . . 0.0 110.24 -172.593 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.3 p -78.5 119.67 27.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.7 0 C-N-CA 123.153 0.581 . . . . 0.0 110.354 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.475 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.5 p -93.24 137.55 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.566 172.075 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.15 -51.5 8.9 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.614 0.766 . . . . 0.0 110.829 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -161.25 169.45 22.16 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.671 0.607 . . . . 0.0 111.511 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.416 HG11 ' HD2' ' A' ' 20' ' ' TYR . 58.6 t -100.19 143.12 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.286 172.473 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.437 HD12 HD22 ' A' ' 32' ' ' ASN . 72.4 mt -108.52 -39.2 5.47 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.218 1.007 . . . . 0.0 111.429 178.574 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -154.02 166.4 33.13 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 122.755 0.422 . . . . 0.0 110.957 -174.2 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.575 HH11 HD21 ' A' ' 50' ' ' LEU . 53.5 ttt180 -142.2 148.73 38.67 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.738 1.215 . . . . 0.0 110.36 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -152.36 174.56 13.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.723 1.209 . . . . 0.0 109.25 173.958 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.586 HG22 HG22 ' A' ' 18' ' ' VAL . 94.6 t -123.11 116.03 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.667 0.787 . . . . 0.0 109.796 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -118.56 121.24 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.074 0.949 . . . . 0.0 109.369 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 64.05 23.6 13.29 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.86 1.264 . . . . 0.0 112.252 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.51 -23.35 32.64 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.444 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.89 157.33 24.39 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.942 0.897 . . . . 0.0 109.116 176.328 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.586 HG22 HG22 ' A' ' 13' ' ' VAL . 99.4 t -113.08 114.29 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.476 0.71 . . . . 0.0 109.438 -173.981 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.54 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -109.39 134.37 51.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.631 0.773 . . . . 0.0 110.562 -177.801 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.416 ' HD2' HG11 ' A' ' 8' ' ' VAL . 48.8 m-85 -108.77 128.46 54.9 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.055 0.942 . . . . 0.0 109.774 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.92 108.37 9.92 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.615 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 32' ' ' ASN . 57.8 mt -82.8 -174.71 5.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.547 0.689 . . . . 0.0 112.236 -171.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -144.71 112.91 6.47 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 103.947 -2.612 . . . . 0.0 103.947 163.96 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 87.5 m95 -79.03 147.75 32.73 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.012 0.434 . . . . 0.0 111.411 -173.834 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -85.1 -36.21 21.3 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.506 172.525 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -73.19 -28.98 65.17 Favored Glycine 0 C--N 1.357 1.696 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.317 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -120.43 171.91 8.19 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.769 0.828 . . . . 0.0 110.956 -174.737 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.6 p -70.65 161.78 30.14 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 123.182 0.593 . . . . 0.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.72 -27.09 65.63 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.4 0.68 . . . . 0.0 112.109 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.46 -19.02 34.05 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.449 0.7 . . . . 0.0 111.263 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.53 1.62 41.05 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.37 0.668 . . . . 0.0 110.886 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.474 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 31.1 p-10 -56.96 146.98 25.1 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 124.368 1.067 . . . . 0.0 112.718 175.587 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.439 HG21 HM32 ' B' ' 9' ' ' M3L . 7.2 p -140.9 158.71 43.57 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.4 -173.294 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -76.95 115.95 17.19 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.111 0.965 . . . . 0.0 110.31 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -124.56 131.3 24.14 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.554 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . 63.8 Cg_endo -70.85 154.61 63.33 Favored 'Trans proline' 0 C--N 1.365 1.395 0 C-N-CA 122.439 2.092 . . . . 0.0 112.438 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -28.34 56.45 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.469 1.107 . . . . 0.0 112.289 178.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.554 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.3 pt-20 -66.27 -31.92 73.02 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 123.664 0.603 . . . . 0.0 111.279 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.403 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 3.1 m-20 -93.9 -18.47 21.93 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.942 0.897 . . . . 0.0 111.593 177.925 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.43 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 61.1 mt -76.75 124.86 28.31 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 176.936 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -103.48 23.82 12.0 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 171.258 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.508 ' HB3' ' HB3' ' B' ' 5' ' ' GLN . 21.3 p -112.52 89.67 13.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 123.942 0.897 . . . . 0.0 110.505 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -73.63 -33.02 7.08 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.888 2.392 . . . . 0.0 111.814 173.635 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.96 -50.21 73.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.559 -1.201 . . . . 0.0 111.418 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.422 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 77.8 mt -70.22 -36.84 74.83 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.599 -175.708 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.2 -49.7 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.803 0.441 . . . . 0.0 110.405 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.97 -50.63 72.72 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.573 0.546 . . . . 0.0 110.626 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.62 -38.76 85.81 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 124.056 0.848 . . . . 0.0 111.457 -176.992 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -64.06 -42.92 96.85 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.733 0.813 . . . . 0.0 111.508 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.575 HD21 HH11 ' A' ' 11' ' ' ARG . 84.2 mt -68.52 -35.46 77.5 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.092 0.557 . . . . 0.0 110.396 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -66.4 -31.34 72.04 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.136 0.974 . . . . 0.0 110.948 175.072 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -69.72 -38.86 77.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.377 0.671 . . . . 0.0 110.833 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 57.2 mt-30 -71.98 -27.69 62.92 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.386 0.674 . . . . 0.0 111.543 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.568 -0.73 . . . . 0.0 109.335 -178.834 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 120.502 0.191 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 mmt180 -97.31 104.22 16.22 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.418 0.687 . . . . 0.0 110.3 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 52.3 p -85.53 86.82 7.35 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.31 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -100.04 131.21 46.14 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.999 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.508 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.7 mm-40 -123.42 137.83 54.72 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.254 1.022 . . . . 0.0 108.662 174.351 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 28.2 p -97.71 147.38 24.42 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.391 0.676 . . . . 0.0 111.215 -175.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.12 144.02 24.53 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.145 0.978 . . . . 0.0 109.845 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 16.1 mtp180 -106.74 130.66 54.42 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.182 0.993 . . . . 0.0 108.69 -178.115 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.439 HM32 HG21 ' A' ' 33' ' ' THR . . . . . . . . 0 N--CA 1.469 0.491 0 CA-C-O 121.054 0.454 . . . . 0.0 110.761 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 27.0 t -72.05 84.81 1.0 Allowed 'General case' 0 C--O 1.242 0.704 0 C-N-CA 124.751 1.22 . . . . 0.0 110.165 178.965 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 30.6 p -78.77 86.5 4.7 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.696 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.78 -157.35 18.69 Favored Glycine 0 C--N 1.342 0.914 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.44 -171.176 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -172.04 112.86 0.46 Allowed Glycine 0 C--N 1.344 1.02 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.588 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' B' B ' 14' ' ' LYS . . . . . 0.531 ' HA ' ' HE3' ' B' ' 14' ' ' LYS . 0.8 OUTLIER -73.81 89.0 1.81 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 122.967 0.507 . . . . 0.0 110.503 -176.132 . . . . . . . . 3 3 . 1 . 001 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.911 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.206 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.222 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.464 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 4.9 mp0 -91.14 147.05 23.33 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 123.905 0.882 . . . . 0.0 108.963 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -145.98 155.53 42.89 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.444 0.698 . . . . 0.0 109.394 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.42 109.71 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.544 0.738 . . . . 0.0 111.887 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.528 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.7 p -85.11 137.48 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 165.141 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -76.74 -54.64 6.36 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.199 0.6 . . . . 0.0 110.311 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.44 ' HA ' HD13 ' A' ' 45' ' ' LEU . 19.3 ptmt -160.28 164.94 32.23 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.001 0.52 . . . . 0.0 111.97 177.76 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.439 HG11 ' HD2' ' A' ' 20' ' ' TYR . 89.6 t -86.73 134.58 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.356 1.062 . . . . 0.0 109.614 171.977 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.2 mt -101.6 -39.15 7.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.507 0.723 . . . . 0.0 110.887 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -149.41 165.37 32.27 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.518 0.327 . . . . 0.0 110.696 -172.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -132.97 144.03 49.85 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.277 1.031 . . . . 0.0 109.154 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.34 172.44 15.38 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.778 0.831 . . . . 0.0 109.684 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 18' ' ' VAL . 76.5 t -127.5 121.95 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.302 1.041 . . . . 0.0 108.976 175.2 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.468 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 69.2 t -129.38 125.79 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 63.96 20.0 12.01 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.412 1.085 . . . . 0.0 112.332 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.79 -12.86 62.63 Favored Glycine 0 C--N 1.348 1.244 0 CA-C-O 119.949 -0.362 . . . . 0.0 113.974 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptpt -98.4 165.32 11.9 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.404 0.602 . . . . 0.0 109.459 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 13' ' ' VAL . 56.5 t -107.96 119.37 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.12 0.568 . . . . 0.0 109.685 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.7 mt-10 -110.16 139.0 45.77 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.406 0.682 . . . . 0.0 110.211 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HD2' HG11 ' A' ' 8' ' ' VAL . 61.7 m-85 -111.57 140.68 45.98 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.659 0.784 . . . . 0.0 110.11 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -79.08 108.04 12.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.469 HD22 HG21 ' A' ' 5' ' ' VAL . 23.2 mt -95.37 120.47 35.67 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.115 0.566 . . . . 0.0 110.757 -174.883 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.757 ' HD3' ' HA ' ' A' ' 29' ' ' ASP . 0.0 OUTLIER -91.62 113.03 25.19 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 166.33 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.528 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 68.9 m95 -79.06 150.12 31.94 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.817 0.847 . . . . 0.0 111.03 -173.541 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -88.79 -39.37 13.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.944 0.498 . . . . 0.0 111.156 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.67 -33.37 60.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.217 177.804 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -94.03 162.44 13.88 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.398 0.679 . . . . 0.0 110.289 174.089 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.1 p -72.36 172.11 10.97 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.507 0.723 . . . . 0.0 111.631 -177.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.757 ' HA ' ' HD3' ' A' ' 23' ' ' LYS . 1.2 m-20 -69.44 -17.59 63.65 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.281 0.632 . . . . 0.0 110.919 173.341 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.75 -19.09 60.37 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.778 0.831 . . . . 0.0 111.7 173.787 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -121.78 85.36 2.4 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.634 0.731 . . . . 0.0 109.466 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.433 ' HB3' ' HA ' ' A' ' 23' ' ' LYS . 6.9 p30 -125.61 136.48 53.31 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.749 1.22 . . . . 0.0 110.179 173.674 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.42 HG21 HM22 ' B' ' 9' ' ' M3L . 64.2 p -130.85 154.79 47.68 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.656 0.783 . . . . 0.0 111.114 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -80.84 123.68 28.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.967 0.907 . . . . 0.0 110.313 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -123.79 138.94 31.29 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 123.186 0.594 . . . . 0.0 109.563 171.482 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 60.9 Cg_endo -68.83 158.94 55.84 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 122.726 2.284 . . . . 0.0 112.302 175.878 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.463 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 11.3 pt-20 -65.74 -26.05 67.56 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.106 0.562 . . . . 0.0 111.615 -175.816 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.482 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.9 pt-20 -62.07 -32.19 72.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.959 0.904 . . . . 0.0 110.971 175.227 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.425 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 7.9 m-20 -80.09 -32.32 39.2 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.85 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.465 ' CD2' HD11 ' A' ' 22' ' ' LEU . 13.4 mt -72.27 131.97 43.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.055 -176.983 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -123.97 66.38 1.04 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.688 ' SG ' ' HG2' ' B' ' 5' ' ' GLN . 36.2 t -152.6 112.07 2.77 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 114.38 -1.282 . . . . 0.0 110.353 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -78.71 -23.54 8.14 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.125 1.883 . . . . 0.0 111.885 168.314 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -63.32 -58.7 6.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.987 0.915 . . . . 0.0 111.872 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.452 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 87.5 mt -72.18 -39.16 68.85 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.642 0.777 . . . . 0.0 112.285 -169.947 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.7 mt -65.41 -51.2 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 123.692 0.62 . . . . 0.0 110.406 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -66.0 -40.66 91.34 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.076 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.29 -37.06 86.01 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.832 0.453 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.13 -46.27 91.26 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.783 0.833 . . . . 0.0 110.534 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.2 mt -68.48 -37.22 79.95 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.145 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -82.61 -14.86 54.05 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.635 0.774 . . . . 0.0 112.077 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 t -81.26 -24.05 37.58 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.171 0.588 . . . . 0.0 109.901 174.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 45.7 mt-30 -70.37 -29.1 65.68 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.896 171.205 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt . . . . . 0 CA--C 1.551 0.992 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.994 176.28 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.276 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -103.4 7.47 38.08 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.667 0.787 . . . . 0.0 111.762 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 3' ' ' THR . . . . . 0.647 ' HB ' HE22 ' B' ' 5' ' ' GLN . 12.7 p -88.57 117.28 27.41 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.613 0.765 . . . . 0.0 112.042 -173.189 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -105.6 105.49 15.55 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.246 0.618 . . . . 0.0 109.403 176.695 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.688 ' HG2' ' SG ' ' A' ' 42' ' ' CYS . 27.2 mp0 -127.75 127.7 44.06 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.894 0.478 . . . . 0.0 109.887 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 54.1 m -72.06 117.78 14.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.449 1.1 . . . . 0.0 109.707 177.372 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.67 110.81 7.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.05 0.54 . . . . 0.0 109.918 176.796 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.464 ' HA ' ' HA ' ' A' ' 2' ' ' GLU . 39.6 ttt180 -65.82 144.37 56.89 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.548 1.139 . . . . 0.0 111.085 177.503 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.42 HM22 HG21 ' A' ' 33' ' ' THR . . . . . . . . 0 C--O 1.237 0.416 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.993 169.341 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 29.6 t -75.97 81.42 2.84 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.174 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 76.7 p -80.91 -22.83 39.4 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.021 -177.456 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -130.44 75.1 0.43 Allowed Glycine 0 C--N 1.349 1.251 0 N-CA-C 111.904 -0.478 . . . . 0.0 111.904 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.06 78.9 1.2 Allowed Glycine 0 C--N 1.347 1.186 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 172.588 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -153.1 169.84 21.96 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.613 0.765 . . . . 0.0 111.133 -170.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.209 0 C-N-CA 124.238 1.015 . . . . 0.0 108.484 176.433 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.526 ' HA2' ' HG2' ' B' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.48 1.588 0 N-CA-C 112.683 -0.167 . . . . 0.0 112.683 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -153.85 -32.47 0.11 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.083 0.953 . . . . 0.0 109.869 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -69.99 151.81 45.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.299 0.639 . . . . 0.0 110.378 -177.202 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.47 HG13 ' O ' ' A' ' 25' ' ' LYS . 3.0 p -113.23 125.18 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 123.124 0.57 . . . . 0.0 110.658 -174.554 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.586 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.1 p -114.88 140.04 38.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 124.677 1.191 . . . . 0.0 110.405 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -73.24 -57.34 4.09 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.365 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.472 ' HA ' HD22 ' A' ' 45' ' ' LEU . 21.2 ptmt -164.2 162.57 22.76 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.307 0.575 . . . . 0.0 112.368 -174.722 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.528 HG23 ' HB3' ' A' ' 45' ' ' LEU . 93.3 t -84.3 143.7 11.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-N 114.649 -1.159 . . . . 0.0 108.857 169.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.54 -42.57 4.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.236 0.614 . . . . 0.0 110.577 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -151.77 164.86 36.1 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.84 0.456 . . . . 0.0 110.538 -171.871 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.4 ' HB2' ' HE2' ' A' ' 49' ' ' PHE . 77.3 ttt180 -124.18 159.54 29.87 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.415 1.086 . . . . 0.0 110.206 -174.941 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -159.43 167.09 29.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.634 0.774 . . . . 0.0 109.329 173.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -121.89 121.11 63.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.522 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 89.9 t -125.3 114.85 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.239 1.016 . . . . 0.0 109.041 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 65.78 12.06 8.05 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.329 1.051 . . . . 0.0 112.275 174.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 110.56 -25.04 16.06 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 123.315 0.484 . . . . 0.0 113.37 -174.698 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.8 ptpt -81.52 174.26 11.6 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 85.1 t -120.79 123.77 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.61 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 39.9 mt-10 -105.51 138.33 41.88 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.228 0.537 . . . . 0.0 110.341 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -111.84 136.66 50.83 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.548 1.139 . . . . 0.0 109.171 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -80.21 105.56 11.57 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.433 HD22 HG21 ' A' ' 5' ' ' VAL . 23.5 mt -91.62 112.63 24.63 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.512 -175.973 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 32' ' ' ASN . 0.1 OUTLIER -85.0 105.83 16.05 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 165.727 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.586 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 80.3 m95 -73.84 154.01 39.66 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.439 0.695 . . . . 0.0 112.039 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 4' ' ' VAL . 25.4 ttpp -112.14 151.41 29.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.1 -48.32 4.01 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -174.627 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -66.96 165.62 15.21 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.201 1.0 . . . . 0.0 109.584 165.248 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -65.75 152.43 44.32 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-O 120.812 0.339 . . . . 0.0 110.988 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.45 -31.56 70.95 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.764 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.38 -17.46 56.43 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.192 0.597 . . . . 0.0 111.597 176.495 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -84.59 65.32 8.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.856 0.862 . . . . 0.0 109.486 -178.718 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.563 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 16.2 p30 -111.03 149.08 31.24 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.006 1.322 . . . . 0.0 110.57 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 52.5 p -139.36 164.52 29.62 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.938 0.895 . . . . 0.0 110.476 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -86.15 123.78 31.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.72 133.69 24.99 Favored Pre-proline 0 N--CA 1.472 0.634 0 C-N-CA 122.818 0.447 . . . . 0.0 110.576 172.678 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.61 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 43.7 Cg_endo -65.77 160.61 42.88 Favored 'Trans proline' 0 C--N 1.366 1.485 0 C-N-CA 122.572 2.181 . . . . 0.0 112.384 176.691 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -25.47 65.58 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.62 1.168 . . . . 0.0 112.021 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.437 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 13.0 pt-20 -68.68 -23.02 64.34 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.406 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -89.98 -22.58 21.85 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.689 1.195 . . . . 0.0 111.488 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.421 ' CD2' HD11 ' A' ' 22' ' ' LEU . 21.1 mt -77.79 117.0 18.74 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.901 0.48 . . . . 0.0 111.426 -172.024 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.29 -27.56 27.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.508 ' SG ' ' HG ' ' A' ' 45' ' ' LEU . 51.1 t -80.62 109.38 12.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 123.891 0.876 . . . . 0.0 110.714 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -79.07 -17.86 11.66 Favored 'Trans proline' 0 C--N 1.377 2.037 0 C-N-CA 122.274 1.983 . . . . 0.0 111.476 173.551 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.441 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 12.7 tp10 -65.52 -52.44 52.59 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 124.644 1.178 . . . . 0.0 110.917 -176.693 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.528 ' HB3' HG23 ' A' ' 8' ' ' VAL . 75.3 mt -64.9 -29.23 70.16 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.196 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.513 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 31.7 mt -70.63 -55.84 12.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.23 -55.83 21.65 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.474 -170.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.74 79.28 Favored 'General case' 0 N--CA 1.481 1.109 0 O-C-N 124.082 0.863 . . . . 0.0 111.611 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.4 ' HE2' ' HB2' ' A' ' 11' ' ' ARG . 58.0 t80 -63.98 -39.03 93.2 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.463 1.105 . . . . 0.0 111.727 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 89.7 mt -67.76 -38.11 83.01 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.535 0.334 . . . . 0.0 110.281 178.394 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.04 -28.33 65.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.664 . . . . 0.0 111.195 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m -64.87 -24.32 67.5 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.243 0.617 . . . . 0.0 111.451 176.737 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -104.61 -4.49 22.48 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.076 0.95 . . . . 0.0 111.081 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt . . . . . 0 C--O 1.25 1.089 0 C-N-CA 123.95 0.9 . . . . 0.0 109.032 -175.255 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 121.145 0.497 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -120.0 129.74 54.41 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.958 0.903 . . . . 0.0 110.355 -176.158 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 8.7 t -95.29 135.31 37.05 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.806 0.843 . . . . 0.0 111.032 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -93.33 71.56 4.45 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.526 0.679 . . . . 0.0 110.028 176.1 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 76.4 mt-30 -71.38 135.11 47.14 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.891 175.417 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 19.2 m -111.02 150.14 29.73 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 121.49 0.662 . . . . 0.0 111.151 -165.652 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.49 18.39 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 124.934 1.293 . . . . 0.0 109.381 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.526 ' HG2' ' HA2' ' A' ' 1' ' ' GLY . 0.0 OUTLIER -119.29 146.02 45.62 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.38 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.474 ' N ' ' HD3' ' B' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.471 0.614 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 169.899 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 32.4 t -62.49 122.67 16.33 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 123.84 0.712 . . . . 0.0 109.286 -179.246 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 39.8 p -60.04 -20.27 57.08 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 124.335 1.054 . . . . 0.0 112.736 -176.354 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.35 -121.94 0.85 Allowed Glycine 0 C--N 1.342 0.894 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 173.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -152.13 150.6 22.48 Favored Glycine 0 C--N 1.336 0.557 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -145.51 129.68 17.59 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.754 0.822 . . . . 0.0 109.183 -177.611 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.141 0 C-N-CA 124.121 0.968 . . . . 0.0 109.457 -176.485 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.433 0 N-CA-C 113.281 0.073 . . . . 0.0 113.281 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -96.23 -55.1 3.06 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.968 0.507 . . . . 0.0 110.55 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -130.86 146.24 52.24 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.515 0.726 . . . . 0.0 110.0 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.475 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 11.1 m -66.75 134.0 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.019 176.768 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -101.97 131.65 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.568 0.747 . . . . 0.0 109.351 173.715 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.37 -56.28 7.05 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.379 0.671 . . . . 0.0 110.585 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.481 ' HA ' HD22 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -159.3 163.07 36.05 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.121 0.486 . . . . 0.0 111.673 -177.234 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 45' ' ' LEU . 72.2 t -82.04 129.19 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.586 171.603 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.3 mt -86.67 -54.5 4.35 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.199 1.0 . . . . 0.0 110.176 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -151.9 164.51 36.95 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.27 -172.96 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -131.17 141.22 50.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.392 1.077 . . . . 0.0 109.297 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -136.45 171.05 15.06 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.786 0.834 . . . . 0.0 109.561 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 17' ' ' LYS . 90.4 t -124.1 115.2 44.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 124.205 1.002 . . . . 0.0 108.95 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.421 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 92.4 t -126.31 127.97 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.161 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.7 t30 66.08 15.86 10.24 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.2 1.0 . . . . 0.0 111.031 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.54 14.57 75.74 Favored Glycine 0 C--N 1.35 1.33 0 CA-C-N 116.03 -0.532 . . . . 0.0 113.651 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 14.5 ptmt -108.92 157.25 18.8 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.4 t -96.67 125.24 49.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.554 0.741 . . . . 0.0 109.742 177.464 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 47.1 mt-10 -120.93 135.98 55.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.389 0.676 . . . . 0.0 109.997 174.336 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.414 ' HE2' ' HB3' ' A' ' 37' ' ' GLU . 96.3 m-85 -109.79 129.47 55.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.447 1.099 . . . . 0.0 109.893 177.693 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.23 107.95 8.82 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 174.985 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 5' ' ' VAL . 18.3 mt -102.66 127.44 49.77 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 122.876 0.47 . . . . 0.0 111.347 -172.314 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? -96.01 121.28 37.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.58 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.458 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 66.4 m95 -82.2 137.77 34.84 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.147 0.579 . . . . 0.0 111.27 -173.025 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.411 ' HB3' HG23 ' A' ' 4' ' ' VAL . 37.7 ttpt -76.6 132.28 39.36 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 123.665 0.786 . . . . 0.0 110.576 -173.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.78 -0.24 89.58 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.689 0.618 . . . . 0.0 113.834 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -104.86 173.36 6.33 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.324 1.05 . . . . 0.0 110.966 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.1 p -65.44 162.05 18.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.791 0.836 . . . . 0.0 112.015 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.81 -41.6 99.36 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.532 0.733 . . . . 0.0 111.248 -176.894 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.63 -16.59 63.41 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.256 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -81.24 77.73 8.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.139 0.976 . . . . 0.0 109.168 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 0.2 OUTLIER -143.02 131.51 22.33 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 113.987 -1.461 . . . . 0.0 109.794 175.242 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 p -131.74 147.42 52.5 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.957 0.903 . . . . 0.0 110.465 -173.809 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -76.49 109.53 10.3 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.88 0.472 . . . . 0.0 110.041 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -114.12 129.69 24.59 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.403 1.081 . . . . 0.0 110.458 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 72.7 Cg_endo -72.29 150.81 53.56 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.442 2.095 . . . . 0.0 111.985 175.799 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.514 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.06 -26.69 64.84 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.319 1.048 . . . . 0.0 113.09 -176.671 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.85 -31.56 72.58 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.658 0.783 . . . . 0.0 111.215 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -91.44 -14.23 30.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.033 0.933 . . . . 0.0 110.555 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.514 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 10.0 mt -79.07 141.01 37.74 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.786 0.434 . . . . 0.0 110.096 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -97.06 0.2 48.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.247 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.513 ' HA ' ' HG2' ' B' ' 5' ' ' GLN . 33.5 t -111.02 96.98 32.55 Favored Pre-proline 0 C--N 1.356 0.848 0 C-N-CA 123.661 0.785 . . . . 0.0 111.453 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -78.85 -17.15 12.41 Favored 'Trans proline' 0 C--N 1.375 1.953 0 C-N-CA 122.665 2.243 . . . . 0.0 111.578 169.956 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -71.13 -43.94 66.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.024 0.929 . . . . 0.0 110.737 -176.606 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 7' ' ' LYS . 21.2 mt -68.35 -40.18 81.61 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.124 0.569 . . . . 0.0 111.55 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.528 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 66.6 mt -58.62 -52.15 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 123.814 0.696 . . . . 0.0 109.781 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.9 -52.66 64.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.568 0.747 . . . . 0.0 111.298 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.32 71.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.856 0.862 . . . . 0.0 111.598 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.7 -45.3 71.96 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.129 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 79.9 mt -64.85 -35.97 82.85 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 110.403 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 -74.04 -29.09 61.73 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.101 0.96 . . . . 0.0 110.299 178.937 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 24.8 t -75.61 -18.74 59.61 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.43 0.692 . . . . 0.0 110.626 177.306 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -73.38 -33.34 64.98 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.081 0.552 . . . . 0.0 110.055 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt . . . . . 0 C--O 1.252 1.234 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.321 -179.364 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -74.38 -22.64 59.09 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.981 168.4 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 81.6 p -75.55 145.76 41.0 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 124.16 0.984 . . . . 0.0 111.841 -172.187 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -121.85 -6.45 9.05 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.903 176.393 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.513 ' HG2' ' HA ' ' A' ' 42' ' ' CYS . 25.3 tp60 -75.8 154.93 35.9 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.231 0.613 . . . . 0.0 111.457 -166.869 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 2.0 m -107.02 171.88 7.13 Favored 'General case' 0 CA--C 1.561 1.374 0 C-N-CA 124.021 0.928 . . . . 0.0 110.729 -166.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.8 144.46 17.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.751 0.82 . . . . 0.0 109.423 171.473 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -88.66 144.38 26.33 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.977 0.511 . . . . 0.0 109.995 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.695 0 C-N-CA 123.465 0.706 . . . . 0.0 109.932 176.639 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 49.5 m -74.36 87.25 2.02 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.23 0.612 . . . . 0.0 109.42 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 37.0 m -123.91 104.75 9.11 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.772 0.829 . . . . 0.0 109.362 -178.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.68 -49.5 0.06 OUTLIER Glycine 0 C--N 1.343 0.961 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 68.54 -91.07 0.25 Allowed Glycine 0 C--N 1.349 1.268 0 O-C-N 124.128 0.546 . . . . 0.0 112.582 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.39 156.17 26.8 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.45 0.7 . . . . 0.0 110.478 175.068 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.194 0 C-N-CA 124.202 1.001 . . . . 0.0 108.665 175.544 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 112.813 -0.115 . . . . 0.0 112.813 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -101.06 -31.75 10.93 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.116 0.566 . . . . 0.0 111.614 -174.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -129.88 137.94 50.68 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.247 0.619 . . . . 0.0 110.216 -173.988 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -80.66 110.81 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.825 0.821 . . . . 0.0 110.388 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.416 HG21 HD22 ' A' ' 22' ' ' LEU . 1.4 p -81.6 131.39 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.733 168.353 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.505 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 39.1 tt0 -74.94 -49.49 19.97 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 174.427 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.89 162.42 29.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.318 0.58 . . . . 0.0 111.015 -172.825 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.488 HG11 ' HD2' ' A' ' 20' ' ' TYR . 61.1 t -89.99 141.27 14.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.363 172.145 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.3 mt -105.42 -47.6 3.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.96 0.904 . . . . 0.0 109.918 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -144.62 164.47 30.85 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 55.6 ttt180 -138.75 126.5 22.16 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.324 1.05 . . . . 0.0 109.509 -175.595 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -126.83 164.17 21.98 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.761 0.824 . . . . 0.0 109.856 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.8 t -125.61 116.79 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.2 t -123.62 118.9 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.088 0.955 . . . . 0.0 109.559 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 62.34 32.6 16.88 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.811 1.245 . . . . 0.0 111.784 175.493 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.2 -26.81 11.8 Favored Glycine 0 N--CA 1.472 1.046 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.301 -177.478 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -79.44 152.74 30.14 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 123.995 0.918 . . . . 0.0 109.48 -177.811 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.9 t -114.34 113.69 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.546 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 49.7 mt-10 -106.49 153.47 22.25 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.971 0.908 . . . . 0.0 110.536 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.488 ' HD2' HG11 ' A' ' 8' ' ' VAL . 92.6 m-85 -132.01 126.88 35.02 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.296 1.038 . . . . 0.0 108.95 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -77.55 107.47 10.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.416 HD22 HG21 ' A' ' 5' ' ' VAL . 42.3 mt -96.71 123.34 40.37 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.112 0.565 . . . . 0.0 111.734 -168.987 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -73.83 106.05 5.38 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 165.474 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.496 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 76.4 m95 -78.93 116.92 19.55 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 173.851 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . 38.7 ttpt -61.9 -41.05 97.43 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.756 0.823 . . . . 0.0 112.338 -170.449 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.62 5.83 79.99 Favored Glycine 0 CA--C 1.534 1.274 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -132.09 170.73 14.56 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.691 0.796 . . . . 0.0 111.407 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 77.5 p -72.83 160.99 31.29 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.533 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.9 -29.56 63.24 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.342 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -22.43 63.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.991 0.516 . . . . 0.0 111.351 174.926 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -92.29 -1.13 57.28 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.541 0.737 . . . . 0.0 111.164 -178.506 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.496 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 84.4 m-20 -64.89 139.49 58.77 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.978 0.511 . . . . 0.0 110.666 173.372 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 39.5 p -131.57 155.77 46.92 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.185 0.594 . . . . 0.0 112.116 -170.894 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -77.3 113.48 15.12 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.532 0.733 . . . . 0.0 109.444 171.978 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -121.9 129.56 25.1 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 122.913 0.485 . . . . 0.0 110.379 176.647 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.546 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 73.4 Cg_endo -71.75 149.89 55.23 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 122.737 2.291 . . . . 0.0 112.18 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.445 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 9.5 pt-20 -60.28 -24.0 64.58 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.867 0.867 . . . . 0.0 112.741 -175.405 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.51 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 9.3 pt-20 -65.81 -35.36 80.48 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.902 0.881 . . . . 0.0 111.307 175.773 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -82.42 -21.94 35.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.386 1.074 . . . . 0.0 110.687 -175.191 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.532 HD22 ' HB1' ' B' ' 7' ' ' ALA . 7.6 mt -86.14 142.14 28.87 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -108.75 26.13 10.93 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 173.382 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 47.0 t -117.28 90.85 35.4 Favored Pre-proline 0 C--N 1.346 0.451 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.902 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -70.96 -22.16 26.93 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 122.507 2.138 . . . . 0.0 111.013 170.202 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.86 -60.18 3.95 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 124.118 0.967 . . . . 0.0 111.445 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.44 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 89.6 mt -78.22 -29.73 48.45 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.802 0.441 . . . . 0.0 112.027 -172.031 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 93.0 mt -63.68 -56.08 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -41.56 69.66 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.594 -174.385 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -34.23 77.68 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.046 0.216 . . . . 0.0 111.148 -177.871 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -60.42 -44.21 95.98 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.606 0.762 . . . . 0.0 110.799 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 69.4 mt -66.92 -39.02 87.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.781 178.019 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -71.61 -21.77 61.8 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.904 0.882 . . . . 0.0 111.42 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.1 m -72.23 -31.19 65.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.064 0.545 . . . . 0.0 110.226 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -77.01 -32.77 57.38 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.332 0.653 . . . . 0.0 110.559 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? . . . . . 0 C--O 1.25 1.088 0 C-N-CA 123.622 0.769 . . . . 0.0 109.475 -176.32 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -84.59 -1.72 56.38 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.74 0.816 . . . . 0.0 111.028 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 13.6 p -65.16 97.32 0.25 Allowed 'General case' 0 C--O 1.244 0.796 0 C-N-CA 123.596 0.758 . . . . 0.0 110.994 174.359 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 26.6 mtpp -68.86 145.91 53.3 Favored 'General case' 0 C--O 1.244 0.764 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 168.392 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.479 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 20.5 tp60 -56.84 123.02 13.59 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 123.717 0.635 . . . . 0.0 110.029 -172.491 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -86.75 173.98 9.12 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 124.106 0.963 . . . . 0.0 113.075 -160.419 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 7' ' ' ALA . . . . . 0.532 ' HB1' HD22 ' A' ' 40' ' ' LEU . . . -147.78 155.06 41.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -97.11 164.93 12.3 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.407 HM33 ' CD1' ' A' ' 24' ' ' TRP . . . . . . . . 0 N--CA 1.474 0.751 0 CA-C-O 121.301 0.572 . . . . 0.0 109.837 168.831 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 13.3 p -75.9 95.11 3.46 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.116 -177.48 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.1 t -142.24 136.4 29.82 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 124.181 0.993 . . . . 0.0 108.941 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.13 -64.52 0.03 OUTLIER Glycine 0 C--N 1.34 0.784 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 169.7 120.21 0.52 Allowed Glycine 0 C--N 1.346 1.107 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -99.99 135.85 40.79 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.682 0.793 . . . . 0.0 109.811 176.233 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.34 0 C-N-CA 123.015 0.526 . . . . 0.0 109.764 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.418 ' HA3' ' HB3' ' B' ' 9' ' ' M3L . . . . . . . . 0 N--CA 1.486 2.008 0 N-CA-C 111.799 -0.52 . . . . 0.0 111.799 . . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.707 ' HG3' ' HG2' ' B' ' 8' ' ' ARG . 7.1 mp0 -81.49 121.14 25.91 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.804 0.842 . . . . 0.0 109.591 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.453 ' HE2' ' H ' ' A' ' 26' ' ' GLY . 47.1 t80 -139.6 154.1 47.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.456 0.702 . . . . 0.0 109.635 179.156 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 65.5 t -77.68 116.87 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.086 0.555 . . . . 0.0 110.926 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.455 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.2 p -92.55 142.0 13.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 123.863 0.865 . . . . 0.0 110.66 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -79.64 -57.85 3.47 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.173 0.989 . . . . 0.0 110.848 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -160.81 169.39 22.8 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.794 0.438 . . . . 0.0 111.866 -175.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.441 HG13 ' HB3' ' A' ' 20' ' ' TYR . 43.9 t -92.17 141.45 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.061 0.944 . . . . 0.0 109.194 171.057 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.1 mt -111.43 -35.4 5.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.508 1.123 . . . . 0.0 110.786 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -157.26 164.62 37.49 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.434 0.694 . . . . 0.0 109.812 -173.299 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -132.7 154.02 50.56 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.985 0.914 . . . . 0.0 109.971 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.24 161.47 40.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.956 0.902 . . . . 0.0 109.28 174.788 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t -116.87 124.19 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 169.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 47.0 t -112.49 108.83 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 176.384 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.5 m120 64.97 -73.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.153 1.381 . . . . 0.0 111.033 -172.961 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -147.72 -9.34 0.2 Allowed Glycine 0 CA--C 1.528 0.852 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.607 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' A' ' 36' ' ' PRO . 15.6 ptmt -81.28 170.47 16.02 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.543 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 99.1 t -124.51 127.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.139 0.576 . . . . 0.0 109.497 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -118.33 139.52 51.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.441 ' HB3' HG13 ' A' ' 8' ' ' VAL . 98.0 m-85 -111.28 132.66 54.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.293 1.037 . . . . 0.0 109.641 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -78.42 108.56 11.86 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.8 mt -101.41 123.04 44.84 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.34 0.656 . . . . 0.0 112.169 -168.065 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -78.07 110.13 12.76 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 165.737 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.559 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 71.9 m95 -80.7 148.95 29.94 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 122.862 0.465 . . . . 0.0 110.342 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.607 ' HD3' ' HD3' ' B' ' 4' ' ' LYS . 33.2 ttpt -58.52 -48.44 80.84 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 123.67 0.606 . . . . 0.0 110.94 178.835 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLY . . . . . 0.453 ' H ' ' HE2' ' A' ' 3' ' ' PHE . . . -103.76 15.3 52.61 Favored Glycine 0 C--N 1.34 0.805 0 CA-C-N 115.584 -0.735 . . . . 0.0 114.207 -173.374 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.559 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 55.5 m-85 -132.83 136.64 46.38 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 117.605 0.702 . . . . 0.0 109.925 175.267 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.5 p -80.71 -179.22 7.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.292 1.037 . . . . 0.0 111.835 -175.662 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.422 ' HA ' ' ND2' ' A' ' 32' ' ' ASN . 33.1 t70 -49.83 -51.45 39.83 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.135 1.374 . . . . 0.0 113.582 -170.313 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.12 -20.84 62.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 27' ' ' PHE . 11.1 t70 -91.25 -17.85 25.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.833 0.453 . . . . 0.0 111.209 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.422 ' ND2' ' HA ' ' A' ' 29' ' ' ASP . 84.1 m-20 -58.17 136.99 57.36 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.479 0.712 . . . . 0.0 111.672 -177.93 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 33' ' ' THR . . . . . 0.538 HG21 HM12 ' B' ' 9' ' ' M3L . 33.8 p -128.41 156.79 42.6 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.372 0.669 . . . . 0.0 112.669 -166.758 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -80.32 117.53 21.16 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.095 0.958 . . . . 0.0 110.369 173.618 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -118.66 135.52 23.72 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 123.006 0.523 . . . . 0.0 110.311 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.509 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . 94.9 Cg_endo -74.55 150.94 41.29 Favored 'Trans proline' 0 C--N 1.365 1.425 0 C-N-CA 122.463 2.109 . . . . 0.0 112.511 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -27.69 64.46 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.032 0.933 . . . . 0.0 112.572 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 15.7 pt-20 -60.7 -35.75 77.08 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.199 0.6 . . . . 0.0 110.94 177.326 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -83.51 -34.78 25.24 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.788 0.835 . . . . 0.0 111.149 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.528 HD12 HD11 ' A' ' 46' ' ' ILE . 19.2 mt -62.78 136.75 58.03 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -170.172 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -108.57 29.52 7.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 171.731 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.473 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 19.7 m -116.27 89.51 26.39 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.262 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.97 -26.48 6.58 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.742 1.628 . . . . 0.0 111.097 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.51 -56.14 13.99 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 124.328 1.051 . . . . 0.0 111.127 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.541 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 83.9 mt -65.95 -40.26 91.17 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.677 0.61 . . . . 0.0 111.638 -174.012 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.528 HD11 HD12 ' A' ' 40' ' ' LEU . 76.5 mt -66.36 -47.94 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.472 0.483 . . . . 0.0 110.54 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.34 -50.85 72.16 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.317 0.647 . . . . 0.0 110.794 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -37.25 85.92 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.534 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -64.2 -49.75 70.79 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.132 0.973 . . . . 0.0 110.805 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 80.0 mt -66.24 -38.61 88.3 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.904 -177.728 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -78.16 -18.32 55.71 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.8 t -76.56 -28.66 56.34 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 120.898 0.38 . . . . 0.0 110.016 174.162 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -83.02 -37.56 23.77 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.707 0.803 . . . . 0.0 110.327 177.709 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm . . . . . 0 CA--C 1.547 0.848 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.892 179.717 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -19.85 59.24 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 122.66 0.384 . . . . 0.0 110.094 172.629 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 24.7 m -63.48 83.56 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.131 0.972 . . . . 0.0 109.66 175.4 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.607 ' HD3' ' HD3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -144.62 114.29 7.21 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.66 1.184 . . . . 0.0 109.073 -172.35 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.541 ' HG3' ' HG ' ' A' ' 45' ' ' LEU . 87.4 mm-40 -94.24 156.3 16.61 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.281 0.632 . . . . 0.0 110.556 -178.275 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 37.4 m -110.63 137.35 48.43 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.534 0.733 . . . . 0.0 109.24 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -129.1 145.47 51.28 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.866 0.866 . . . . 0.0 108.988 176.604 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.707 ' HG2' ' HG3' ' A' ' 2' ' ' GLU . 67.2 mtt85 -105.6 139.93 39.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.852 -172.585 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.538 HM12 HG21 ' A' ' 33' ' ' THR . . . . . . . . 0 C--O 1.244 0.764 0 C-N-CA 123.34 0.656 . . . . 0.0 109.271 173.571 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 22.3 t -65.85 168.3 8.18 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.603 0.761 . . . . 0.0 111.168 174.587 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 75.4 p 50.81 75.85 0.17 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.89 1.276 . . . . 0.0 110.917 -173.356 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.32 -101.04 0.24 Allowed Glycine 0 C--N 1.342 0.898 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.539 -174.034 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 68.97 11.42 63.35 Favored Glycine 0 C--N 1.348 1.218 0 O-C-N 123.688 0.287 . . . . 0.0 113.562 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.32 118.3 9.4 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.367 1.067 . . . . 0.0 109.278 -175.572 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' B' B ' 15' ' ' ALA . . . . . 0.442 ' HB2' ' HG2' ' A' ' 2' ' ' GLU . . . . . . . . 0 C--O 1.251 1.182 0 C-N-CA 123.74 0.816 . . . . 0.0 108.966 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.803 0 N-CA-C 112.299 -0.321 . . . . 0.0 112.299 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -76.77 164.34 25.95 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.241 0.616 . . . . 0.0 109.508 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -81.72 114.91 20.7 Favored 'General case' 0 C--N 1.349 0.554 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -169.558 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.513 HG22 HG22 ' B' ' 6' ' ' THR . 47.0 t -84.35 132.08 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 176.192 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.498 HG21 HD22 ' A' ' 22' ' ' LEU . 1.2 p -100.88 121.8 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 109.325 -0.621 . . . . 0.0 109.325 172.461 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 14.8 tp10 -53.59 -57.22 11.52 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.554 1.142 . . . . 0.0 110.821 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -164.21 162.03 22.42 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 -174.26 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.494 HG13 ' HB3' ' A' ' 20' ' ' TYR . 85.9 t -85.28 116.71 29.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.599 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.1 mt -82.9 -35.69 25.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.013 0.525 . . . . 0.0 111.888 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -164.56 162.73 21.84 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.259 0.349 . . . . 0.0 110.995 -171.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.484 ' NH2' HD21 ' A' ' 50' ' ' LEU . 31.3 ttm180 -118.59 149.26 41.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.309 1.044 . . . . 0.0 109.539 173.538 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -132.2 160.78 35.12 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 165.651 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 85.9 t -120.95 108.46 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 167.327 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.61 128.56 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.371 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 66.02 22.2 11.23 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.843 1.257 . . . . 0.0 111.772 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.45 6.08 89.05 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.781 -0.645 . . . . 0.0 113.357 -176.056 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -104.26 143.13 33.37 Favored 'General case' 0 C--N 1.348 0.523 0 C-N-CA 124.285 1.034 . . . . 0.0 109.702 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -91.08 119.45 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.402 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.53 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 43.0 mt-10 -128.19 162.71 26.34 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.144 0.978 . . . . 0.0 109.576 -178.919 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.494 ' HB3' HG13 ' A' ' 8' ' ' VAL . 87.7 m-85 -140.68 134.45 30.39 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.528 0.731 . . . . 0.0 110.147 -172.56 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -78.51 106.94 10.81 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 174.502 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.688 HD11 HD22 ' A' ' 40' ' ' LEU . 28.4 mt -87.98 123.35 32.6 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.351 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -78.11 99.45 6.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.052 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.551 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 63.0 m95 -63.88 126.26 27.05 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 171.427 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.571 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 38.0 ttpt -51.21 -54.44 25.59 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.411 1.484 . . . . 0.0 113.516 -164.589 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.75 30.69 9.78 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 116.78 -0.191 . . . . 0.0 112.855 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.551 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.6 m-85 -135.55 142.21 45.33 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.375 0.67 . . . . 0.0 110.234 -178.859 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.8 p -64.75 159.24 22.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.251 1.02 . . . . 0.0 112.141 -175.506 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.23 -34.81 78.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.298 0.639 . . . . 0.0 112.064 -177.005 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.82 -19.3 64.27 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.424 0.69 . . . . 0.0 111.546 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -99.82 -18.4 17.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.452 1.101 . . . . 0.0 110.844 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.482 ' HB3' ' O ' ' A' ' 22' ' ' LEU . 11.8 m120 -68.11 146.61 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.195 0.598 . . . . 0.0 111.183 175.821 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 42.7 p -126.07 165.06 19.54 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.32 0.648 . . . . 0.0 112.358 -166.333 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -88.4 116.9 26.95 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.993 0.917 . . . . 0.0 109.847 173.089 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -121.8 133.62 24.35 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 123.688 0.795 . . . . 0.0 110.744 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.53 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 58.2 Cg_endo -69.26 156.07 65.72 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.591 2.194 . . . . 0.0 111.667 176.472 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.419 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -51.49 -30.16 19.08 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.367 1.067 . . . . 0.0 113.43 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.42 -37.91 80.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.336 0.654 . . . . 0.0 110.983 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -89.83 3.26 53.49 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.491 0.717 . . . . 0.0 111.1 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.688 HD22 HD11 ' A' ' 22' ' ' LEU . 10.8 mt -88.66 124.25 33.9 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.994 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.451 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 32.5 t70 -84.1 -33.57 24.32 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 175.946 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.564 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 17.6 p -71.57 109.44 5.52 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 124.403 1.081 . . . . 0.0 110.839 174.364 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.451 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 73.4 Cg_endo -87.12 -19.39 2.52 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.253 1.968 . . . . 0.0 111.953 170.923 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.57 -35.58 60.57 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.932 0.893 . . . . 0.0 110.789 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.2 mt -69.98 -32.63 70.94 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.614 0.366 . . . . 0.0 110.865 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 29.3 mt -68.49 -46.56 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 37.1 tt0 -62.13 -45.23 94.36 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.51 178.846 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.74 -32.14 73.25 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.173 0.589 . . . . 0.0 111.627 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.45 -40.19 96.48 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.85 0.86 . . . . 0.0 110.501 173.08 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.484 HD21 ' NH2' ' A' ' 11' ' ' ARG . 91.4 mt -73.22 -34.79 66.11 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.363 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.45 ' HA ' ' HB2' ' A' ' 54' ' ' LYS . 12.7 m120 -76.7 -14.97 59.91 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.835 0.854 . . . . 0.0 111.084 179.578 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.3 t -70.48 -37.21 74.22 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.868 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -78.06 -34.94 50.12 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.987 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.45 ' HB2' ' HA ' ' A' ' 51' ' ' ASN . 30.4 mmmt . . . . . 0 C--O 1.251 1.178 0 C-N-CA 124.076 0.951 . . . . 0.0 110.312 -176.366 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 57.78 28.5 16.02 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 124.179 0.991 . . . . 0.0 111.468 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 39.6 p -76.47 91.45 3.33 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 124.003 0.921 . . . . 0.0 110.74 -172.415 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -80.52 79.51 7.11 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.246 1.022 . . . . 0.0 110.281 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.564 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 46.1 tt0 -140.73 19.0 2.34 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 114.145 -1.389 . . . . 0.0 108.563 177.889 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.513 HG22 HG22 ' A' ' 4' ' ' VAL . 21.8 p -96.27 179.42 5.05 Favored 'General case' 0 C--O 1.246 0.92 0 C-N-CA 124.284 1.033 . . . . 0.0 111.55 -176.425 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -176.97 179.97 0.98 Allowed 'General case' 0 C--O 1.246 0.912 0 C-N-CA 125.336 1.454 . . . . 0.0 108.71 177.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.1 ttp85 -128.29 156.05 43.65 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.805 0.842 . . . . 0.0 108.839 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.435 0 C-N-CA 122.779 0.432 . . . . 0.0 110.522 175.295 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 31.3 p -74.25 151.04 39.98 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.178 0.991 . . . . 0.0 110.31 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 52.8 p -90.06 31.28 0.99 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 110.183 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -68.36 -48.76 49.81 Favored Glycine 0 C--N 1.355 1.638 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.324 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 69.25 -83.69 0.25 Allowed Glycine 0 C--N 1.354 1.539 0 C-N-CA 123.209 0.433 . . . . 0.0 112.691 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -83.11 -21.88 33.53 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.106 0.963 . . . . 0.0 110.101 174.979 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.144 0 C-N-CA 123.566 0.746 . . . . 0.0 110.277 173.929 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.529 0 N-CA-C 111.896 -0.482 . . . . 0.0 111.896 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -91.06 115.77 28.28 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 173.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -117.26 142.26 47.28 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.391 0.677 . . . . 0.0 110.14 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.65 122.5 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.551 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -97.26 134.9 33.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 123.657 0.783 . . . . 0.0 109.427 175.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.0 -55.98 9.18 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.003 0.921 . . . . 0.0 109.752 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -162.92 166.75 23.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.443 0.697 . . . . 0.0 110.875 -174.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.414 HG11 ' HD2' ' A' ' 20' ' ' TYR . 60.0 t -90.41 142.34 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 169.941 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.7 mt -106.77 -45.58 4.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.707 0.803 . . . . 0.0 111.058 -178.808 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -149.6 161.85 41.35 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.811 0.339 . . . . 0.0 110.933 -175.559 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -122.42 151.87 40.8 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.092 1.357 . . . . 0.0 108.605 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -153.23 163.58 39.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.123 0.569 . . . . 0.0 110.272 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.2 t -117.59 115.11 47.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 123.961 0.904 . . . . 0.0 109.178 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.413 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 88.6 t -116.45 109.85 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.362 1.065 . . . . 0.0 109.47 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.8 m120 60.93 17.92 8.32 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 124.303 1.041 . . . . 0.0 112.851 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.91 -24.38 14.93 Favored Glycine 0 C--N 1.347 1.159 0 CA-C-O 119.829 -0.428 . . . . 0.0 113.367 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptmt -81.92 170.98 14.99 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.951 0.5 . . . . 0.0 109.823 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -120.54 118.57 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.229 0.612 . . . . 0.0 110.214 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.571 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 61.6 mt-10 -111.02 152.23 27.09 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.809 0.844 . . . . 0.0 110.687 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.434 ' HE1' ' HB3' ' A' ' 37' ' ' GLU . 94.0 m-85 -130.09 126.9 38.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.651 1.18 . . . . 0.0 109.268 -176.216 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -78.32 108.35 11.6 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.481 HD11 HD22 ' A' ' 40' ' ' LEU . 39.9 mt -90.29 122.39 33.15 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 -174.225 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.37 96.79 6.11 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 163.189 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.5 m95 -67.88 135.27 52.23 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.364 0.415 . . . . 0.0 110.241 179.231 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -69.92 131.25 44.13 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.9 -35.27 3.82 Favored Glycine 0 C--N 1.347 1.145 0 O-C-N 123.314 0.384 . . . . 0.0 112.903 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.56 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 64.6 m-85 -91.65 144.74 25.21 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.636 0.775 . . . . 0.0 109.875 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.1 p -73.77 163.37 28.05 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.861 0.864 . . . . 0.0 112.1 -174.173 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.429 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.9 p-10 -59.55 -33.76 71.82 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.846 0.858 . . . . 0.0 111.389 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.03 -28.1 60.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.846 0.858 . . . . 0.0 111.839 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -88.51 -11.87 44.53 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.491 0.716 . . . . 0.0 111.25 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.552 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.8 m120 -63.25 157.66 22.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.1 p -143.65 154.67 43.76 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.488 0.715 . . . . 0.0 111.403 -172.707 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -77.54 124.02 27.37 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.899 0.88 . . . . 0.0 109.139 171.787 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -124.68 129.63 24.55 Favored Pre-proline 0 N--CA 1.468 0.458 0 C-N-CA 123.15 0.58 . . . . 0.0 110.761 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.571 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 51.4 Cg_endo -66.7 159.82 49.35 Favored 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.685 2.257 . . . . 0.0 111.91 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.434 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -64.69 -24.77 67.68 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.551 0.74 . . . . 0.0 112.786 -176.277 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.02 -31.45 72.64 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.961 0.904 . . . . 0.0 110.624 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.03 -12.86 32.02 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.525 1.13 . . . . 0.0 111.216 -172.6 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.481 HD22 HD11 ' A' ' 22' ' ' LEU . 21.5 mt -86.53 120.97 28.43 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.502 0.721 . . . . 0.0 110.346 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 41' ' ' ASP . . . . . 0.487 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 26.9 t70 -83.08 -30.1 28.26 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 173.451 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.1 p -78.23 106.29 3.87 Favored Pre-proline 0 CA--C 1.559 1.319 0 C-N-CA 124.8 1.24 . . . . 0.0 112.164 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.487 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 64.8 Cg_endo -87.96 -18.51 2.31 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.736 2.291 . . . . 0.0 113.064 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' GLU . . . . . 0.429 ' HB3' ' OE1' ' B' ' 5' ' ' GLN . 35.2 tt0 -75.25 -36.22 61.3 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.722 0.809 . . . . 0.0 110.441 -174.976 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -67.22 -39.7 86.3 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.113 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 62.7 mt -63.39 -47.55 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 176.548 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.97 -53.27 60.25 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.264 1.026 . . . . 0.0 111.296 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.92 -33.63 74.6 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.609 0.764 . . . . 0.0 111.109 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -71.34 -36.87 71.69 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.169 0.988 . . . . 0.0 111.421 176.228 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 96.8 mt -67.83 -36.72 80.85 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 176.537 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -67.27 -28.41 68.01 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.256 1.022 . . . . 0.0 110.529 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.9 m -74.81 -38.04 62.19 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.198 0.599 . . . . 0.0 110.557 175.58 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 58.1 mt-30 -70.16 -35.51 74.06 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.803 179.531 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? . . . . . 0 CA--C 1.549 0.928 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -176.862 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -65.08 -67.38 0.44 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 176.198 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 43.2 p -86.42 150.38 24.34 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.069 0.547 . . . . 0.0 109.574 174.048 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -73.81 135.57 43.49 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 170.393 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.429 ' OE1' ' HB3' ' A' ' 44' ' ' GLU . 33.3 mm-40 -62.72 97.17 0.1 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.887 0.742 . . . . 0.0 111.053 -172.905 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 8.8 t -127.22 159.87 32.99 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 123.81 0.844 . . . . 0.0 110.43 -173.599 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -156.55 163.83 38.92 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.987 1.315 . . . . 0.0 108.094 173.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.469 ' HD2' ' N ' ' B' ' 8' ' ' ARG . 1.8 mpt_? -101.92 176.94 5.04 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.797 0 O-C-N 122.04 -0.412 . . . . 0.0 110.022 175.122 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 22.8 t -59.89 108.55 0.77 Allowed 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.096 1.358 . . . . 0.0 110.693 -170.004 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 23.7 m -71.31 100.21 2.09 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.009 -177.909 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.66 135.18 17.68 Favored Glycine 0 C--N 1.342 0.902 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.791 -177.723 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -94.1 93.54 1.7 Allowed Glycine 0 C--N 1.346 1.107 0 C-N-CA 123.328 0.49 . . . . 0.0 112.051 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -79.99 73.01 6.79 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.597 0.759 . . . . 0.0 109.437 175.051 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.887 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.584 -173.801 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.766 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -104.41 -44.71 4.86 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.037 0.935 . . . . 0.0 111.2 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -110.17 119.36 39.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.798 0.839 . . . . 0.0 109.921 -167.267 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 18.9 t -78.44 134.0 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 122.75 0.42 . . . . 0.0 110.613 -174.553 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.45 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -112.92 135.82 51.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.865 1.266 . . . . 0.0 110.285 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.689 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 18.1 tp10 -70.05 -54.82 11.42 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.924 1.29 . . . . 0.0 110.962 175.842 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.689 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.19 169.08 5.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.034 0.934 . . . . 0.0 111.104 170.827 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.5 t -77.16 141.26 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.966 172.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.1 mt -109.34 -41.15 4.71 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.645 0.778 . . . . 0.0 111.179 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -147.12 164.28 33.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.886 0.474 . . . . 0.0 110.322 -169.333 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -132.89 151.63 52.0 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.423 1.089 . . . . 0.0 110.137 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -148.68 163.89 35.96 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.219 1.007 . . . . 0.0 109.522 174.16 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.0 t -115.99 108.37 24.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 170.08 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.1 t -91.34 110.2 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.5 m120 66.68 -73.3 0.08 Allowed 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.955 1.302 . . . . 0.0 111.201 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -160.26 34.66 0.43 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 175.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.4 ptmt -130.82 151.54 51.14 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.469 0.708 . . . . 0.0 109.601 177.509 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 95.3 t -90.54 130.15 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 122.634 0.374 . . . . 0.0 110.19 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 25.9 mt-10 -124.97 149.05 48.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 109.739 170.379 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.504 ' HB2' HD11 ' A' ' 40' ' ' LEU . 92.4 m-85 -122.93 132.59 54.23 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.22 1.008 . . . . 0.0 110.026 -178.561 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -78.12 109.38 12.16 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.194 0.997 . . . . 0.0 108.778 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.514 HD11 HD22 ' A' ' 40' ' ' LEU . 20.6 mt -88.81 126.07 35.19 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.06 0.544 . . . . 0.0 111.139 -176.488 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -80.0 107.43 12.78 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 162.181 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.529 ' CD1' ' HA ' ' A' ' 32' ' ' ASN . 90.3 m95 -72.33 134.38 45.46 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.591 0.356 . . . . 0.0 110.795 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -69.83 -60.78 2.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.844 0.858 . . . . 0.0 111.158 -173.067 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.76 32.84 6.38 Favored Glycine 0 C--N 1.344 0.976 0 CA-C-N 115.774 -0.648 . . . . 0.0 113.321 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.41 ' HD2' ' HB3' ' A' ' 24' ' ' TRP . 85.4 m-85 -137.27 163.91 29.8 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.124 0.969 . . . . 0.0 108.689 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.7 t -72.57 164.96 25.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.096 0.558 . . . . 0.0 111.619 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -73.12 -42.95 62.36 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.662 0.785 . . . . 0.0 112.692 -165.317 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.53 -13.66 60.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.986 0.515 . . . . 0.0 111.858 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -79.35 -10.89 59.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.218 1.007 . . . . 0.0 111.994 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.529 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 68.5 m-20 -64.99 136.13 56.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.117 0.567 . . . . 0.0 112.319 -174.429 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.3 p -138.4 162.29 34.79 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.249 0.62 . . . . 0.0 112.341 -165.632 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -79.0 123.11 26.98 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.515 1.126 . . . . 0.0 111.123 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.42 ' HB2' HD21 ' A' ' 40' ' ' LEU . 57.2 mm-40 -121.65 135.1 24.88 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 171.913 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 38.5 Cg_endo -65.35 155.87 66.33 Favored 'Trans proline' 0 C--N 1.372 1.764 0 C-N-CA 122.329 2.019 . . . . 0.0 111.333 175.046 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.401 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.01 -26.24 62.13 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.74 0.816 . . . . 0.0 112.502 -178.923 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.424 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 10.4 pt-20 -71.64 -27.94 63.43 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.451 0.701 . . . . 0.0 110.841 178.63 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.484 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.7 m-20 -88.7 -16.37 32.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.924 0.89 . . . . 0.0 111.43 177.636 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.514 HD22 HD11 ' A' ' 22' ' ' LEU . 23.6 mt -77.28 124.9 28.48 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.723 0.409 . . . . 0.0 110.362 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.97 24.0 12.82 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 p -121.29 89.11 46.45 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 123.652 0.781 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' PRO . . . . . 0.434 ' HD2' HE22 ' B' ' 5' ' ' GLN . 29.0 Cg_exo -65.35 -48.17 3.64 Favored 'Trans proline' 0 C--N 1.376 1.982 0 C-N-CA 123.063 2.509 . . . . 0.0 113.736 -177.44 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -64.42 -29.57 70.62 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.696 0.799 . . . . 0.0 112.165 -173.738 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 7' ' ' LYS . 53.1 mt -78.04 -35.84 49.24 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.399 0.68 . . . . 0.0 111.426 -176.669 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 71.6 mt -65.2 -47.51 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.41 -46.02 80.39 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.191 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.13 84.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.028 0.931 . . . . 0.0 110.923 -176.054 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -68.16 -46.35 71.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.918 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.23 -24.25 63.06 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.321 0.649 . . . . 0.0 110.178 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -74.78 -25.75 59.28 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.622 1.169 . . . . 0.0 109.853 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.2 m -72.13 -27.16 62.43 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.52 172.924 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -80.92 -13.32 59.02 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.014 0.926 . . . . 0.0 110.887 173.187 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? . . . . . 0 C--O 1.251 1.158 0 C-N-CA 124.462 1.105 . . . . 0.0 109.765 -178.853 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 76.19 -49.85 0.59 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 125.515 1.526 . . . . 0.0 112.919 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 4.6 t -54.13 94.68 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.333 1.053 . . . . 0.0 111.951 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 3.9 ttmp? -81.1 83.06 6.86 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.116 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.434 HE22 ' HD2' ' A' ' 43' ' ' PRO . 16.0 mm-40 -72.57 117.97 14.9 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.205 178.85 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 10.1 t -131.94 179.12 6.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.349 -165.508 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.89 -179.61 8.22 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.84 0.856 . . . . 0.0 110.635 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.484 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 76.6 ttt180 -130.27 129.11 42.86 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.082 1.353 . . . . 0.0 107.698 -173.072 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.417 ' HA ' ' OE1' ' A' ' 35' ' ' GLU . . . . . . . . 0 N--CA 1.484 1.264 0 CA-C-N 118.912 0.778 . . . . 0.0 112.609 -174.926 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 39.9 m -143.43 144.94 32.23 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.07 0.548 . . . . 0.0 109.655 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 49.1 m -71.59 85.5 0.88 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -101.59 117.0 5.71 Favored Glycine 0 C--N 1.35 1.31 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.867 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -101.99 -87.32 1.98 Allowed Glycine 0 C--N 1.347 1.184 0 N-CA-C 110.303 -1.119 . . . . 0.0 110.303 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -157.91 -80.95 0.06 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.541 0.737 . . . . 0.0 109.651 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.108 0 C-N-CA 123.716 0.806 . . . . 0.0 109.372 -177.701 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.483 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' B' ' 8' ' ' ARG . 9.5 pt-20 -137.45 -17.82 1.3 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.21 0.604 . . . . 0.0 111.77 -179.024 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -141.27 136.59 31.77 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.259 0.624 . . . . 0.0 110.311 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 30.6 m -73.45 134.86 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.567 0.747 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.434 HG21 HD22 ' A' ' 22' ' ' LEU . 1.7 p -125.79 133.5 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.511 0.724 . . . . 0.0 110.014 174.838 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.822 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 10.6 tp10 -56.11 -64.84 0.73 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.364 1.466 . . . . 0.0 110.58 172.875 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.822 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.83 170.12 4.68 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.313 1.045 . . . . 0.0 110.689 169.831 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 49' ' ' PHE . 63.4 t -66.07 139.55 21.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.07 172.033 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 23' ' ' LYS . 86.3 mt -111.63 -30.14 7.46 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 123.78 0.832 . . . . 0.0 110.865 -177.869 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -159.43 163.39 35.46 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.638 0.375 . . . . 0.0 110.702 -172.905 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -136.33 147.69 47.53 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.103 0.961 . . . . 0.0 110.397 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -151.09 172.72 15.32 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.473 1.109 . . . . 0.0 108.821 174.593 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -129.98 118.54 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.518 0.727 . . . . 0.0 109.273 174.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.1 t -125.98 123.82 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.078 0.951 . . . . 0.0 109.335 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.9 m120 62.99 26.72 15.64 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.763 1.225 . . . . 0.0 111.969 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.76 -23.5 30.48 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.269 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -77.66 148.95 34.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.711 1.205 . . . . 0.0 109.458 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.9 t -106.12 116.06 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.629 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -104.41 154.62 19.63 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 110.261 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.433 ' HD1' HG11 ' A' ' 8' ' ' VAL . 91.1 m-85 -138.48 124.27 19.86 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.484 1.114 . . . . 0.0 109.519 -175.327 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -78.5 109.3 12.55 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.434 HD22 HG21 ' A' ' 5' ' ' VAL . 54.2 mt -96.36 127.66 42.56 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.613 0.765 . . . . 0.0 111.209 -172.849 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 6' ' ' GLU . 3.4 tmtp? -80.11 96.87 6.63 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 167.18 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.577 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 92.5 m95 -63.95 117.58 7.22 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.4 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HE2' ' HE2' ' B' ' 4' ' ' LYS . 13.1 ttpp -66.11 -34.19 77.5 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 124.22 0.95 . . . . 0.0 111.829 -168.571 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.73 16.95 60.13 Favored Glycine 0 C--N 1.343 0.965 0 CA-C-N 115.977 -0.556 . . . . 0.0 113.604 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.439 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 98.7 m-85 -139.01 157.57 45.76 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.662 0.785 . . . . 0.0 110.058 -177.437 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 t -69.09 162.54 26.73 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.274 0.63 . . . . 0.0 111.865 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.68 -34.42 78.17 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.854 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.87 -22.34 60.79 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.088 0.555 . . . . 0.0 111.663 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -88.72 -3.78 58.69 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.833 0.853 . . . . 0.0 110.883 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.577 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.7 m120 -70.03 138.35 52.07 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.06 0.544 . . . . 0.0 111.079 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.0 p -130.36 165.26 22.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.37 0.668 . . . . 0.0 111.821 -170.198 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -83.95 116.41 22.78 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.059 0.944 . . . . 0.0 110.146 173.653 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -117.14 131.56 23.94 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 123.074 0.549 . . . . 0.0 110.116 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.629 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.5 Cg_endo -66.5 165.3 25.56 Favored 'Trans proline' 0 C--N 1.367 1.542 0 C-N-CA 122.392 2.061 . . . . 0.0 113.001 175.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.41 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.22 -29.14 67.3 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.255 1.022 . . . . 0.0 112.546 -178.464 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.35 -34.03 76.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.749 0.819 . . . . 0.0 110.984 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -77.11 -33.64 56.86 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.568 0.747 . . . . 0.0 111.156 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.41 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 34.9 mt -62.08 124.98 22.3 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.517 0.327 . . . . 0.0 111.259 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -108.23 19.54 19.77 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 122.653 1.216 . . . . 0.0 108.151 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.431 ' O ' HG13 ' A' ' 46' ' ' ILE . 12.9 p -127.69 87.52 55.75 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.398 -176.725 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.87 -27.32 26.11 Favored 'Trans proline' 0 C--N 1.377 2.058 0 C-N-CA 122.491 2.127 . . . . 0.0 111.786 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.15 -38.64 82.36 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.696 0.798 . . . . 0.0 111.187 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.554 HD13 ' HA ' ' A' ' 7' ' ' LYS . 77.6 mt -78.73 -23.59 45.37 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.259 0.624 . . . . 0.0 111.312 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 42' ' ' CYS . 79.9 mt -67.3 -52.39 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 169.261 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.16 -44.8 79.63 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.401 1.081 . . . . 0.0 110.994 177.898 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.52 -43.98 97.89 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.64 -177.909 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.468 ' HB2' ' HB ' ' A' ' 8' ' ' VAL . 43.4 t80 -59.43 -47.86 83.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 124.282 0.988 . . . . 0.0 111.102 177.054 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.42 -38.59 84.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.442 0.697 . . . . 0.0 110.548 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.91 -24.63 59.72 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.616 0.766 . . . . 0.0 111.284 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 52.5 m -82.2 -20.3 38.05 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.266 0.626 . . . . 0.0 111.388 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 47.1 mt-30 -73.76 -70.78 0.36 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 122.541 0.336 . . . . 0.0 110.527 178.117 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp . . . . . 0 N--CA 1.484 1.227 0 C-N-CA 124.478 1.111 . . . . 0.0 110.95 -175.938 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -99.43 97.26 8.31 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.071 0.548 . . . . 0.0 109.622 175.743 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 21.0 m -107.09 150.09 26.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.467 0.707 . . . . 0.0 109.698 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.407 ' HE2' ' HE2' ' A' ' 25' ' ' LYS . 16.5 ptpt -102.38 34.85 2.61 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.951 0.9 . . . . 0.0 110.918 176.668 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -69.08 141.66 54.68 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.007 178.353 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 42.8 p -93.2 170.89 9.29 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 122.492 1.139 . . . . 0.0 113.808 -164.901 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.27 -179.82 7.67 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-N 113.737 -1.574 . . . . 0.0 108.692 172.088 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.464 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 31.7 ttm180 -114.4 153.74 29.33 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.601 0.761 . . . . 0.0 109.716 -175.798 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.715 0 C-N-CA 123.006 0.522 . . . . 0.0 110.106 171.344 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 51.0 p -113.97 88.37 2.83 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.685 -170.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.4 m -74.81 -35.73 62.46 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.632 0.773 . . . . 0.0 109.574 168.664 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 90.18 -60.93 3.35 Favored Glycine 0 C--N 1.341 0.807 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.92 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 90.04 -53.96 3.62 Favored Glycine 0 C--N 1.347 1.148 0 N-CA-C 111.807 -0.517 . . . . 0.0 111.807 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -161.46 -50.65 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.541 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.134 0 CA-C-N 115.232 -0.894 . . . . 0.0 108.843 177.639 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.453 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -76.87 132.24 39.03 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 -178.512 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -82.53 122.44 28.07 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -168.634 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.2 t -75.83 130.55 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.494 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -106.57 119.61 56.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.292 0.637 . . . . 0.0 109.927 174.644 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.425 ' HG3' ' HG2' ' A' ' 7' ' ' LYS . 11.7 tp10 -48.35 -57.17 6.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.747 1.619 . . . . 0.0 110.989 172.089 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HG2' ' HG3' ' A' ' 6' ' ' GLU . 3.6 ptpp? -170.36 156.94 5.87 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.72 0.808 . . . . 0.0 110.929 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.427 HG23 ' HB3' ' A' ' 45' ' ' LEU . 85.3 t -71.85 120.27 19.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.869 169.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -87.75 -49.42 7.14 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.265 0.626 . . . . 0.0 110.841 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -147.8 164.88 32.25 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 -170.976 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -137.54 134.73 36.01 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.286 1.034 . . . . 0.0 109.605 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -138.52 175.75 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.325 0.65 . . . . 0.0 109.907 177.004 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -123.18 123.67 68.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 108.452 174.01 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 75.9 t -133.64 122.05 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.766 0.826 . . . . 0.0 109.175 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 66.54 19.67 10.85 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.928 1.291 . . . . 0.0 111.694 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.8 -19.74 53.11 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.923 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -81.66 166.28 20.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.831 0.453 . . . . 0.0 109.85 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.8 t -114.42 110.55 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 123.774 0.83 . . . . 0.0 108.911 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 95.7 mt-10 -104.53 156.1 18.24 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.62 0.768 . . . . 0.0 110.475 -177.726 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.417 ' HD2' HG11 ' A' ' 8' ' ' VAL . 48.0 m-85 -134.9 124.06 24.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.391 1.077 . . . . 0.0 108.444 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -76.72 107.68 9.2 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.577 HD11 HD22 ' A' ' 40' ' ' LEU . 43.0 mt -92.65 123.69 36.12 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.344 -174.632 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -77.38 98.97 5.42 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.634 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 82.9 m95 -67.54 122.01 17.08 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 173.84 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -66.7 -26.99 67.28 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 123.643 0.589 . . . . 0.0 111.905 -175.399 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.28 -7.8 82.35 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-N 116.379 -0.373 . . . . 0.0 113.661 179.471 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -129.44 162.84 27.16 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.593 0.757 . . . . 0.0 110.784 -174.069 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.8 p -73.14 161.63 30.38 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.387 0.675 . . . . 0.0 110.861 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.483 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 21.0 m-20 -57.8 -36.39 72.14 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.576 0.547 . . . . 0.0 110.999 177.902 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.88 -18.0 60.5 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.034 0.934 . . . . 0.0 112.542 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -99.12 -8.1 25.69 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.408 0.283 . . . . 0.0 111.365 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.634 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.9 m120 -65.74 158.55 27.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.452 0.701 . . . . 0.0 112.584 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.0 p -140.76 158.76 43.49 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 121.403 0.621 . . . . 0.0 112.304 -173.494 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -80.67 123.24 28.0 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.862 1.265 . . . . 0.0 109.828 173.525 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -123.3 133.41 24.52 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 122.849 0.46 . . . . 0.0 110.142 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 56.0 Cg_endo -66.98 156.97 63.92 Favored 'Trans proline' 0 C--N 1.371 1.747 0 C-N-CA 122.911 2.407 . . . . 0.0 112.12 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.401 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -56.52 -31.32 63.99 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.852 0.861 . . . . 0.0 113.1 -176.779 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.66 -28.21 68.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.258 1.023 . . . . 0.0 111.736 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.441 ' OD1' ' HB3' ' B' ' 8' ' ' ARG . 57.0 t30 -89.47 -15.23 33.56 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.463 1.105 . . . . 0.0 111.082 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.577 HD22 HD11 ' A' ' 22' ' ' LEU . 28.5 mt -79.04 130.3 35.37 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.099 0.56 . . . . 0.0 110.961 -173.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -105.6 12.53 31.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.891 0.877 . . . . 0.0 109.763 175.314 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.5 p -113.16 90.3 16.07 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.234 1.014 . . . . 0.0 109.166 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.51 -29.53 1.81 Allowed 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.607 2.205 . . . . 0.0 112.958 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.92 -29.34 61.99 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.481 0.712 . . . . 0.0 111.122 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.427 ' HB3' HG23 ' A' ' 8' ' ' VAL . 32.6 mt -68.37 -30.09 68.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.528 0.331 . . . . 0.0 111.605 175.404 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.409 HD11 ' CD1' ' A' ' 40' ' ' LEU . 47.8 mm -71.71 -47.83 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.362 0.414 . . . . 0.0 110.343 176.405 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -54.96 -50.2 69.5 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.819 0.699 . . . . 0.0 110.386 174.756 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.36 -50.71 72.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.763 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.418 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 73.3 t80 -55.85 -50.86 69.43 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.254 1.022 . . . . 0.0 111.756 -178.425 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.43 -47.5 78.89 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.606 0.762 . . . . 0.0 111.128 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -66.16 -23.17 66.42 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.577 0.751 . . . . 0.0 111.524 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.3 m -87.46 -28.72 21.9 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.374 0.67 . . . . 0.0 112.482 -178.922 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.418 ' HG3' ' O ' ' A' ' 49' ' ' PHE . 56.9 mt-30 -61.91 -33.21 73.83 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.536 0.334 . . . . 0.0 111.048 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.559 1.303 0 CA-C-O 117.741 -1.123 . . . . 0.0 109.751 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 120.809 0.338 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.631 ' H ' ' HD3' ' B' ' 2' ' ' ARG . 0.0 OUTLIER -60.36 -22.04 62.81 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.529 1.131 . . . . 0.0 112.025 174.788 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 3.1 p -65.77 105.06 1.18 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.801 0.841 . . . . 0.0 110.588 173.623 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -96.41 144.21 26.75 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.531 0.732 . . . . 0.0 110.93 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 21.9 mt-30 -80.6 75.92 7.47 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.812 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 21.8 p -134.51 169.83 16.68 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.75 0.82 . . . . 0.0 110.738 -170.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -168.26 165.39 13.04 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.864 0.866 . . . . 0.0 109.583 173.795 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.441 ' HB3' ' OD1' ' A' ' 39' ' ' ASN . 38.4 ttm-85 -96.33 178.72 5.28 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 174.37 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.729 0 O-C-N 121.82 -0.55 . . . . 0.0 111.022 173.448 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 51.1 m -75.1 -32.02 61.31 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 161.153 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 18.8 m -96.61 75.8 2.82 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 169.373 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -71.96 -14.58 76.02 Favored Glycine 0 C--N 1.348 1.237 0 CA-C-N 114.906 -1.043 . . . . 0.0 112.159 175.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 130.44 -41.62 1.51 Allowed Glycine 0 C--N 1.348 1.225 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 176.4 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -169.2 -50.23 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.671 0.788 . . . . 0.0 110.077 -176.412 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.791 -179.158 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.79 0 N-CA-C 112.219 -0.352 . . . . 0.0 112.219 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.67 108.41 3.86 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 123.699 0.8 . . . . 0.0 109.956 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.44 ' HD2' ' HA ' ' B' ' 8' ' ' ARG . 67.4 m-85 -77.15 115.71 17.17 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 178.851 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.29 115.54 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.04 -177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.559 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.1 p -98.57 130.66 47.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 124.212 1.005 . . . . 0.0 109.292 171.976 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.83 -62.38 1.9 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.628 0.771 . . . . 0.0 109.912 173.427 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -165.71 168.88 15.75 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.458 0.646 . . . . 0.0 110.943 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.405 HG13 ' HB3' ' A' ' 20' ' ' TYR . 77.8 t -74.1 136.23 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.056 170.582 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.9 mt -103.0 -36.18 8.28 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.41 0.684 . . . . 0.0 110.201 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -156.12 162.74 40.2 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.27 -173.887 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -124.13 143.94 50.19 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.573 1.149 . . . . 0.0 109.344 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -137.78 164.76 28.11 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.728 0.811 . . . . 0.0 109.588 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.486 HG22 HG22 ' A' ' 18' ' ' VAL . 59.2 t -123.8 106.13 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 169.186 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.3 t -85.62 102.92 11.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 172.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 68.22 -76.08 0.06 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.257 1.423 . . . . 0.0 110.813 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.51 -10.29 0.82 Allowed Glycine 0 N--CA 1.477 1.409 0 C-N-CA 123.401 0.524 . . . . 0.0 112.833 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.566 ' HD2' ' HB3' ' A' ' 36' ' ' PRO . 18.7 ttpt -95.83 146.08 24.84 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.978 1.311 . . . . 0.0 109.319 -179.208 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.486 HG22 HG22 ' A' ' 13' ' ' VAL . 85.9 t -98.5 129.35 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.843 0.857 . . . . 0.0 109.822 177.587 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 33.9 mt-10 -121.07 148.05 44.69 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.842 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.405 ' HB3' HG13 ' A' ' 8' ' ' VAL . 88.5 m-85 -116.96 135.82 53.41 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.138 0.975 . . . . 0.0 109.551 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -78.64 106.78 10.86 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.525 HD11 HD22 ' A' ' 40' ' ' LEU . 27.0 mt -92.73 115.55 28.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.57 -173.352 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -76.73 108.94 10.11 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 166.112 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.559 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 81.4 m95 -75.17 123.44 25.26 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.444 0.465 . . . . 0.0 109.818 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -63.76 -48.34 77.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.946 0.898 . . . . 0.0 111.72 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.06 2.5 88.25 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.292 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.545 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 76.9 m-85 -128.69 171.18 12.44 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.965 0.906 . . . . 0.0 109.879 -176.509 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 82.2 p -80.55 166.12 21.46 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -174.288 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -68.64 -27.95 66.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.098 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.2 -16.66 64.07 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.585 0.754 . . . . 0.0 111.256 174.35 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.24 -1.29 21.94 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.739 0.815 . . . . 0.0 111.208 -175.407 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -58.81 126.33 27.2 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.328 0.651 . . . . 0.0 111.351 175.502 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.4 p -129.06 150.63 50.37 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.049 0.54 . . . . 0.0 111.377 -174.831 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -76.94 118.25 19.33 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.792 0.837 . . . . 0.0 109.978 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -119.8 135.78 24.43 Favored Pre-proline 0 N--CA 1.471 0.593 0 C-N-CA 122.645 0.378 . . . . 0.0 110.249 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.566 ' HB3' ' HD2' ' A' ' 17' ' ' LYS . 37.1 Cg_endo -64.71 159.57 44.61 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.7 2.267 . . . . 0.0 113.667 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -54.69 -37.2 65.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.114 1.366 . . . . 0.0 111.858 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.402 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 15.9 pt-20 -72.98 -22.14 60.74 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.836 1.254 . . . . 0.0 111.602 -177.379 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.413 ' HB2' ' HG2' ' A' ' 36' ' ' PRO . 50.2 t30 -90.79 -17.72 26.15 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 124.327 1.051 . . . . 0.0 110.825 -175.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.525 HD22 HD11 ' A' ' 22' ' ' LEU . 11.1 mt -76.84 129.88 36.85 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.117 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -104.82 17.67 23.7 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 170.047 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.416 ' SG ' ' HB3' ' A' ' 40' ' ' LEU . 10.8 p -116.71 90.03 30.28 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.601 1.16 . . . . 0.0 109.629 -175.728 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -80.71 -27.49 3.19 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 122.748 2.299 . . . . 0.0 112.857 -178.765 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -27.79 61.71 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.39 0.676 . . . . 0.0 110.366 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.491 HD21 ' HG2' ' B' ' 5' ' ' GLN . 34.5 mt -71.73 -40.01 69.72 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.268 0.355 . . . . 0.0 111.088 174.147 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.51 -43.61 98.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.87 -45.96 80.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.598 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.32 -31.8 73.12 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.144 -176.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.402 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 68.6 t80 -62.1 -47.87 82.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.638 0.775 . . . . 0.0 110.167 175.793 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 98.7 mt -62.34 -45.95 90.88 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.3 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -68.15 -24.88 65.04 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.386 0.674 . . . . 0.0 111.327 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t -75.42 -63.09 1.36 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.072 0.549 . . . . 0.0 110.664 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 49' ' ' PHE . 3.6 pp0? -90.75 8.87 32.42 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -171.88 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt . . . . . 0 N--CA 1.483 1.202 0 C-N-CA 124.269 1.028 . . . . 0.0 108.606 171.715 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -80.81 -55.58 4.71 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.884 0.474 . . . . 0.0 110.223 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 20.8 p -71.12 96.79 1.4 Allowed 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.251 0.548 . . . . 0.0 109.557 176.822 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -112.67 89.32 3.04 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.513 0.725 . . . . 0.0 110.688 -177.643 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.526 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 0.8 OUTLIER -70.66 105.43 3.15 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.354 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 4.2 t -85.77 138.67 31.92 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.978 0.894 . . . . 0.0 112.577 -168.318 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -154.45 160.12 41.43 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 124.819 1.247 . . . . 0.0 108.166 170.192 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.44 ' HA ' ' HD2' ' A' ' 3' ' ' PHE . 0.1 OUTLIER -106.31 -174.21 2.48 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.092 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.813 0 C-N-CA 123.846 0.858 . . . . 0.0 109.012 174.302 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 71.1 p -67.69 88.39 0.24 Allowed 'General case' 0 CA--C 1.547 0.841 0 CA-C-O 121.748 0.785 . . . . 0.0 109.062 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 69.4 p -71.23 147.79 47.89 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.289 -175.357 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.21 -89.59 1.34 Allowed Glycine 0 C--N 1.34 0.78 0 N-CA-C 111.184 -0.767 . . . . 0.0 111.184 -177.347 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 58.83 -88.63 0.02 OUTLIER Glycine 0 C--N 1.353 1.49 0 O-C-N 124.195 0.585 . . . . 0.0 112.641 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -166.99 76.2 0.17 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.138 1.375 . . . . 0.0 107.535 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.006 0 C-N-CA 123.779 0.832 . . . . 0.0 109.932 -178.271 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.534 0 N-CA-C 112.113 -0.395 . . . . 0.0 112.113 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -149.48 -73.2 0.18 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.568 0.747 . . . . 0.0 110.659 -178.681 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -116.84 114.07 23.4 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.705 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.49 134.68 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-O 120.846 0.355 . . . . 0.0 110.063 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.429 HG21 HD22 ' A' ' 22' ' ' LEU . 2.3 p -116.09 132.9 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.935 0.894 . . . . 0.0 109.966 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -63.51 -57.73 9.27 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.388 1.075 . . . . 0.0 109.351 174.915 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -171.88 168.44 6.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.116 0.966 . . . . 0.0 111.031 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.425 HG11 ' HD1' ' A' ' 20' ' ' TYR . 58.5 t -79.11 144.23 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 123.591 0.756 . . . . 0.0 109.482 172.095 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.6 mt -108.45 -43.34 4.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.286 1.034 . . . . 0.0 111.097 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.65 164.75 35.32 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.171 0.589 . . . . 0.0 110.081 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -129.74 144.52 51.33 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.234 1.014 . . . . 0.0 110.145 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -141.41 167.26 22.59 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.393 1.077 . . . . 0.0 109.953 176.235 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.1 t -126.4 108.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 168.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.27 126.46 61.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 66.55 -71.7 0.09 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.004 1.321 . . . . 0.0 111.123 -174.065 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.85 15.96 0.1 OUTLIER Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.914 176.297 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt -118.33 159.42 23.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.694 0.797 . . . . 0.0 109.711 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.8 t -101.29 118.84 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 123.237 0.615 . . . . 0.0 110.351 -179.25 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.713 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 38.8 mt-10 -104.88 161.25 14.35 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 121.604 0.716 . . . . 0.0 111.885 169.819 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.425 ' HD1' HG11 ' A' ' 8' ' ' VAL . 97.0 m-85 -135.69 128.17 30.51 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.036 1.334 . . . . 0.0 108.793 -177.678 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -77.67 107.24 10.02 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.435 HD11 HD22 ' A' ' 40' ' ' LEU . 18.6 mt -91.17 122.38 33.76 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 122.38 0.272 . . . . 0.0 111.217 -172.528 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -77.26 103.36 7.15 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 164.139 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 94.1 m95 -73.04 139.77 46.8 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 122.613 0.365 . . . . 0.0 110.497 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -90.57 120.14 31.41 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.556 0.742 . . . . 0.0 109.173 -175.77 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.28 -35.23 4.71 Favored Glycine 0 N--CA 1.472 1.1 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 -175.952 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.491 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 65.2 m-85 -80.74 162.31 24.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.108 0.963 . . . . 0.0 109.851 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.4 p -82.38 173.09 12.36 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.849 0.46 . . . . 0.0 110.923 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.21 -16.84 62.53 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.97 0.508 . . . . 0.0 111.686 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.86 -19.66 60.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.412 0.685 . . . . 0.0 111.107 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -88.16 -19.1 27.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.328 0.651 . . . . 0.0 111.54 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -52.76 121.72 7.76 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 123.718 0.636 . . . . 0.0 111.774 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.41 158.47 44.34 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.83 0.852 . . . . 0.0 110.996 -172.859 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.48 109.74 16.98 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.752 0.821 . . . . 0.0 110.63 -178.63 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.413 ' OE1' ' HA ' ' B' ' 9' ' ' M3L . 45.1 mm-40 -112.39 124.66 31.53 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.713 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 27.7 Cg_endo -63.18 161.94 28.39 Favored 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.772 2.315 . . . . 0.0 112.589 175.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -29.36 35.15 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.426 1.09 . . . . 0.0 112.42 178.672 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.474 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.5 pt-20 -67.2 -31.34 71.65 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.068 0.947 . . . . 0.0 111.044 178.796 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -80.31 -30.18 38.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.927 0.891 . . . . 0.0 111.114 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.435 HD22 HD11 ' A' ' 22' ' ' LEU . 13.5 mt -73.14 116.06 13.22 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.556 0.342 . . . . 0.0 110.325 -174.707 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -87.22 -7.57 57.77 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' B' ' 5' ' ' GLN . 12.7 p -92.81 98.81 2.44 Favored Pre-proline 0 C--N 1.354 0.777 0 C-N-CA 125.034 1.334 . . . . 0.0 110.8 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.36 -26.51 8.76 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.21 1.94 . . . . 0.0 111.546 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -77.88 -30.3 50.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.875 1.27 . . . . 0.0 111.606 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 59.5 mt -77.16 -27.4 53.75 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.522 0.329 . . . . 0.0 111.359 177.176 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.418 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 58.1 mt -68.2 -53.05 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 172.13 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.05 -51.89 68.09 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.406 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -42.26 91.22 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 124.041 0.838 . . . . 0.0 111.362 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.45 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 70.2 t80 -60.07 -48.37 82.01 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 0.0 110.942 175.984 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 72.9 mt -65.81 -25.9 67.44 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.35 0.66 . . . . 0.0 111.218 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -80.44 -27.18 38.02 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.567 0.747 . . . . 0.0 111.592 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.3 m -69.52 -51.71 33.16 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.457 0.646 . . . . 0.0 109.974 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 10.6 pt20 -79.66 -46.23 17.55 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.186 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt . . . . . 0 N--CA 1.482 1.144 0 C-N-CA 124.712 1.205 . . . . 0.0 111.062 -172.494 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 013 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -158.24 63.07 0.45 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.334 0.654 . . . . 0.0 110.265 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 27.3 m -79.25 69.96 5.55 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 122.055 0.931 . . . . 0.0 109.428 174.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -130.24 73.46 1.53 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -178.596 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.507 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 5.8 tp60 -115.32 162.22 17.41 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.065 -173.532 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.406 ' H ' ' HG3' ' B' ' 5' ' ' GLN . 11.5 t -100.7 177.22 5.06 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 122.333 1.063 . . . . 0.0 111.341 -176.684 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.24 163.89 39.08 Favored 'General case' 0 C--O 1.247 0.969 0 C-N-CA 125.566 1.546 . . . . 0.0 107.785 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -114.52 161.52 17.92 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.396 1.078 . . . . 0.0 108.47 -172.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.413 ' HA ' ' OE1' ' A' ' 35' ' ' GLU . . . . . . . . 0 N--CA 1.471 0.601 0 C-N-CA 123.024 0.53 . . . . 0.0 109.8 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 52.5 p -98.35 104.17 16.18 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.115 -0.366 . . . . 0.0 110.336 -172.417 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 10.0 t -67.3 -29.95 69.67 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.3 173.329 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -95.01 117.12 5.52 Favored Glycine 0 C--N 1.349 1.302 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 170.526 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -88.57 57.63 4.14 Favored Glycine 0 C--N 1.348 1.214 0 C-N-CA 123.096 0.379 . . . . 0.0 112.937 -174.646 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -149.18 116.97 6.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.498 0.719 . . . . 0.0 109.294 176.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.154 0 C-N-CA 123.829 0.851 . . . . 0.0 109.212 -177.964 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 CA-C-O 119.977 -0.346 . . . . 0.0 112.291 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -75.09 158.5 33.03 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.312 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -77.12 113.43 14.85 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -165.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.8 m -83.22 136.41 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 122.74 0.416 . . . . 0.0 110.1 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.457 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -117.25 129.68 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.935 0.894 . . . . 0.0 110.185 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -70.37 -56.69 6.07 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 124.464 1.106 . . . . 0.0 110.616 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -155.07 161.16 41.38 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.735 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.402 HG23 ' HB3' ' A' ' 45' ' ' LEU . 61.7 t -88.29 136.14 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-N 115.323 -0.853 . . . . 0.0 108.802 168.859 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -102.8 -50.7 3.47 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 110.696 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -150.75 168.09 25.45 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.283 0.633 . . . . 0.0 110.316 -169.822 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -134.2 142.81 47.53 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.543 1.137 . . . . 0.0 111.36 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -134.71 168.88 18.21 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.143 1.377 . . . . 0.0 108.756 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.92 110.78 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.43 0.692 . . . . 0.0 109.347 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 64.3 t -106.47 107.44 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.381 1.072 . . . . 0.0 110.066 176.54 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 57.24 43.31 23.93 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.77 1.228 . . . . 0.0 112.291 170.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.39 -25.2 23.84 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 115.614 -0.721 . . . . 0.0 113.226 177.948 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -91.24 151.45 20.92 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.102 0.961 . . . . 0.0 109.727 179.037 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.8 t -98.03 138.31 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.65 0.78 . . . . 0.0 109.743 177.589 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.608 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.2 mt-10 -121.28 166.48 13.96 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 167.017 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -137.1 152.52 50.1 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.576 1.15 . . . . 0.0 108.836 -177.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -92.5 109.28 20.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.512 HD11 HD21 ' A' ' 40' ' ' LEU . 10.4 mp -92.05 116.52 29.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.109 0.564 . . . . 0.0 110.844 -174.072 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tmtm? -76.36 99.66 4.91 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 105.695 -1.965 . . . . 0.0 105.695 165.738 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.655 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 94.2 m95 -70.16 135.17 48.87 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.421 0.451 . . . . 0.0 111.42 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -78.39 121.04 23.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.533 1.133 . . . . 0.0 109.923 -176.413 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.78 0.0 87.81 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 113.312 -176.966 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.468 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.8 m-85 -118.6 152.45 36.01 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.993 0.917 . . . . 0.0 110.044 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.0 t -77.66 163.66 26.0 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.401 0.68 . . . . 0.0 111.746 -173.699 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.425 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 m-20 -65.44 -31.69 72.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.752 0.821 . . . . 0.0 111.992 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.41 -18.75 65.23 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.502 0.721 . . . . 0.0 111.79 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -108.56 -5.64 16.42 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.169 0.987 . . . . 0.0 111.177 -176.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.655 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.6 m120 -66.37 132.7 48.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.582 0.353 . . . . 0.0 111.102 175.35 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 62.6 p -127.35 160.98 29.73 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.46 0.704 . . . . 0.0 111.41 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -84.45 122.66 29.29 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.998 175.267 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -120.9 137.61 26.73 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 123.012 0.525 . . . . 0.0 110.61 175.642 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.608 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 32.2 Cg_endo -64.05 161.54 33.03 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 122.397 2.065 . . . . 0.0 112.084 173.743 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -24.32 66.33 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.8 179.591 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.457 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 17.1 pt-20 -73.98 -22.44 59.62 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.732 0.813 . . . . 0.0 111.441 178.653 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -87.42 -15.94 36.3 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.423 0.689 . . . . 0.0 111.372 177.089 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.512 HD21 HD11 ' A' ' 22' ' ' LEU . 62.5 mt -72.85 116.39 13.29 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.595 0.358 . . . . 0.0 111.2 -176.572 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 6.81 42.98 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 18.4 p -106.36 92.68 7.18 Favored Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 125.264 1.425 . . . . 0.0 110.147 -178.825 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -38.76 0.49 Allowed 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.605 2.203 . . . . 0.0 113.599 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.25 -21.21 59.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.815 0.446 . . . . 0.0 111.646 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.419 ' HG ' ' OE1' ' B' ' 5' ' ' GLN . 74.0 mt -73.25 -30.22 63.31 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.508 0.323 . . . . 0.0 111.275 174.758 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.4 mt -66.47 -46.53 86.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.615 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -62.86 -43.53 98.55 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.925 176.147 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.42 73.74 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.15 0.58 . . . . 0.0 110.915 -176.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -62.04 -43.57 98.56 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.059 0.944 . . . . 0.0 110.479 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.3 mt -71.18 -29.47 65.22 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.478 0.711 . . . . 0.0 110.291 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -76.55 -15.97 59.73 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.751 0.82 . . . . 0.0 111.189 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 29.7 m -82.9 -12.6 57.24 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.276 0.631 . . . . 0.0 110.393 172.799 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 22.7 mt-30 -93.13 -52.02 4.76 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.488 0.715 . . . . 0.0 109.541 176.963 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 mttm . . . . . 0 C--O 1.254 1.317 0 C-N-CA 125.071 1.349 . . . . 0.0 111.301 -176.833 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -106.81 3.54 26.54 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.558 0.743 . . . . 0.0 110.02 173.893 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 9.5 t -72.62 121.52 19.88 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.9 0.88 . . . . 0.0 111.139 -173.352 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -70.42 -36.37 73.97 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.058 0.943 . . . . 0.0 110.339 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.419 ' OE1' ' HG ' ' A' ' 45' ' ' LEU . 5.3 tp-100 59.59 84.77 0.11 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.922 1.289 . . . . 0.0 110.568 175.322 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.04 176.66 7.45 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.456 -160.402 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -171.89 168.75 5.95 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.587 1.155 . . . . 0.0 109.473 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -111.29 148.25 33.31 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.145 0.978 . . . . 0.0 108.804 177.259 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.723 0 C-N-CA 122.904 0.482 . . . . 0.0 110.475 174.676 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.0 m -79.03 89.01 4.77 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 169.458 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 25.9 p -66.29 102.2 0.82 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.867 0.867 . . . . 0.0 110.738 -175.059 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 70.37 27.18 73.08 Favored Glycine 0 C--N 1.348 1.236 0 CA-C-N 115.273 -0.876 . . . . 0.0 112.777 -173.168 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 78.83 5.91 88.59 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-O 119.88 -0.4 . . . . 0.0 113.565 -175.199 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -122.87 150.57 42.71 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.511 0.724 . . . . 0.0 110.915 -177.094 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.974 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.053 175.85 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' GLY . . . . . 0.557 ' HA2' HG21 ' B' ' 6' ' ' THR . . . . . . . . 0 N--CA 1.478 1.498 0 N-CA-C 112.276 -0.33 . . . . 0.0 112.276 . . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.54 ' HG3' ' HG3' ' B' ' 8' ' ' ARG . 1.6 pm0 -111.72 -86.12 0.56 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.5 0.72 . . . . 0.0 109.479 -177.596 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 3' ' ' PHE . . . . . 0.508 ' H ' ' HG2' ' A' ' 2' ' ' GLU . 37.8 m-85 -102.5 118.8 37.64 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.286 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.513 ' HA ' HG22 ' B' ' 6' ' ' THR . 7.5 p -83.35 136.41 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.306 0.574 . . . . 0.0 111.579 -173.526 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.47 HG21 HD22 ' A' ' 22' ' ' LEU . 1.5 p -118.02 126.84 75.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.253 1.021 . . . . 0.0 109.445 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.25 -51.82 68.32 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.188 1.395 . . . . 0.0 111.514 174.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -170.77 165.54 7.98 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.73 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.472 HG11 ' HD2' ' A' ' 20' ' ' TYR . 98.0 t -82.26 133.59 28.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.596 168.206 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.9 mt -99.98 -38.47 8.58 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.468 0.707 . . . . 0.0 110.429 -178.394 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -153.62 163.6 39.7 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.85 0.46 . . . . 0.0 110.575 -174.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.0 ttt-85 -132.57 145.06 50.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.721 1.209 . . . . 0.0 109.329 -178.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -144.63 163.26 34.48 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.861 0.864 . . . . 0.0 109.655 176.15 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.471 HG22 HG22 ' A' ' 18' ' ' VAL . 88.3 t -122.23 109.49 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.612 0.765 . . . . 0.0 108.941 175.375 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.2 t -113.54 115.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.649 1.179 . . . . 0.0 109.701 177.788 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 64.73 27.71 13.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.839 1.256 . . . . 0.0 112.012 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.15 -11.82 66.24 Favored Glycine 0 N--CA 1.472 1.071 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.121 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -86.3 146.42 26.51 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.471 HG22 HG22 ' A' ' 13' ' ' VAL . 98.4 t -107.16 121.92 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.32 0.648 . . . . 0.0 109.453 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 48.5 mt-10 -112.84 155.91 23.82 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.048 0.939 . . . . 0.0 109.597 177.757 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.472 ' HD2' HG11 ' A' ' 8' ' ' VAL . 96.4 m-85 -132.92 129.45 38.34 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.469 1.108 . . . . 0.0 108.711 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -76.88 107.76 9.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.47 HD22 HG21 ' A' ' 5' ' ' VAL . 16.6 mt -87.51 122.73 31.61 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.9 -175.036 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -76.24 93.17 3.36 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 165.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.56 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 85.6 m95 -65.22 117.61 8.05 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.137 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -70.54 -43.46 69.49 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.308 0.643 . . . . 0.0 110.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.16 13.6 64.48 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.895 -0.593 . . . . 0.0 113.784 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -136.78 161.69 35.28 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.159 0.984 . . . . 0.0 109.801 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.3 p -68.24 159.74 30.62 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.756 0.822 . . . . 0.0 111.795 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.51 -38.27 89.19 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.055 -174.512 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.66 -19.86 65.96 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.341 0.657 . . . . 0.0 111.877 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -96.43 -2.11 46.11 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 123.933 0.893 . . . . 0.0 110.868 -178.733 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.56 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 1.5 m120 -64.94 129.08 38.42 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.631 0.773 . . . . 0.0 110.394 172.5 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 p -138.64 158.72 43.72 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.305 0.642 . . . . 0.0 112.01 -169.564 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -80.79 121.07 25.47 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.636 1.174 . . . . 0.0 111.147 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.487 ' HB2' HD21 ' A' ' 40' ' ' LEU . 49.3 mm-40 -122.59 134.01 24.72 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 123.425 0.69 . . . . 0.0 110.552 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 69.7 Cg_endo -70.6 154.86 64.15 Favored 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.778 2.319 . . . . 0.0 111.813 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.29 -28.39 62.98 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.407 1.083 . . . . 0.0 113.31 -175.327 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.92 -37.71 82.0 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.066 0.946 . . . . 0.0 110.552 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.409 HD22 ' HB3' ' A' ' 35' ' ' GLU . 41.8 t30 -77.58 -23.21 50.02 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 110.604 -178.027 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.487 HD21 ' HB2' ' A' ' 35' ' ' GLU . 57.6 mt -75.02 137.41 41.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.939 -178.456 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -111.68 11.26 21.06 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.909 0.883 . . . . 0.0 109.643 176.784 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.2 p -115.54 90.96 27.52 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 123.813 0.845 . . . . 0.0 111.059 -175.292 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.31 -24.72 14.1 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.615 2.21 . . . . 0.0 111.897 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.84 -52.74 63.9 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.779 1.232 . . . . 0.0 110.926 176.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.16 -33.68 73.78 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.144 -175.477 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.409 HD11 HD13 ' A' ' 40' ' ' LEU . 47.7 mm -68.4 -46.68 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 122.759 0.424 . . . . 0.0 110.391 178.422 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.9 -53.96 52.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.825 0.85 . . . . 0.0 110.522 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.57 -46.69 88.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.835 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -61.99 -52.41 64.11 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.067 0.947 . . . . 0.0 111.93 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.15 -33.6 73.66 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.435 0.694 . . . . 0.0 111.181 -177.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' ASN . . . . . 0.402 ' HA ' ' NZ ' ' A' ' 54' ' ' LYS . 95.4 m-20 -75.38 -37.77 60.35 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.428 0.691 . . . . 0.0 111.491 177.779 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 61.8 m -70.22 -15.39 62.92 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.752 0.821 . . . . 0.0 112.234 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 27.3 mt-30 -67.14 -28.22 67.95 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.073 0.549 . . . . 0.0 111.292 174.473 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.402 ' NZ ' ' HA ' ' A' ' 51' ' ' ASN . 34.2 mtmm . . . . . 0 C--O 1.249 1.06 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 174.713 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.877 0.37 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 69.2 mtm180 -79.11 83.4 5.19 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.675 179.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 22.1 p -109.13 119.02 38.27 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.141 0.976 . . . . 0.0 109.564 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt -83.88 71.07 10.5 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.743 0.817 . . . . 0.0 109.591 178.066 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -100.5 84.64 2.8 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 122.068 0.937 . . . . 0.0 110.43 -174.747 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.557 HG21 ' HA2' ' A' ' 1' ' ' GLY . 40.8 p -134.01 175.18 9.71 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.817 1.247 . . . . 0.0 110.135 -177.633 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.21 161.37 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.633 1.173 . . . . 0.0 109.964 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.564 ' H ' ' HD2' ' B' ' 8' ' ' ARG . 0.1 OUTLIER -90.99 -164.95 1.25 Allowed 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 174.351 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.402 HM13 ' HD2' ' B' ' 9' ' ' M3L . . . . . . . . 0 N--CA 1.48 1.033 0 O-C-N 121.669 -0.644 . . . . 0.0 111.959 178.543 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 23.5 t 72.06 -63.01 0.44 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.603 1.961 . . . . 0.0 110.854 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 62.5 p -75.96 78.41 2.84 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 125.201 1.4 . . . . 0.0 110.741 176.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.61 -34.67 48.79 Favored Glycine 0 C--N 1.343 0.938 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.76 173.275 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -136.43 -170.06 11.89 Favored Glycine 0 C--N 1.347 1.188 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 172.398 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -142.0 132.5 25.27 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.513 0.725 . . . . 0.0 109.777 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 C-N-CA 124.284 1.034 . . . . 0.0 108.338 176.668 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.922 0 N-CA-C 112.585 -0.206 . . . . 0.0 112.585 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLU . . . . . 0.444 ' HG3' ' HD3' ' B' ' 8' ' ' ARG . 3.8 mp0 -90.18 131.53 35.97 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 177.146 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -124.54 156.31 37.57 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.124 0.569 . . . . 0.0 109.669 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.617 HG21 ' HB2' ' B' ' 4' ' ' LYS . 4.2 p -69.72 126.92 30.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 CA-C-O 121.353 0.597 . . . . 0.0 112.284 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.472 HG21 HD22 ' A' ' 22' ' ' LEU . 2.1 p -99.84 120.14 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.483 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.27 -57.96 8.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.733 1.613 . . . . 0.0 111.726 174.054 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -162.52 161.88 27.16 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.52 -174.902 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.5 t -85.49 130.65 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 168.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.7 mt -96.91 -38.54 9.78 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.887 0.875 . . . . 0.0 111.282 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -156.24 164.33 38.48 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.117 -169.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.568 ' HE ' HG11 ' A' ' 18' ' ' VAL . 41.8 ttt180 -134.94 144.33 47.39 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 0.0 110.577 -173.375 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -140.49 163.62 32.34 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.791 0.836 . . . . 0.0 109.798 176.617 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' VAL . . . . . 0.441 HG22 HG22 ' A' ' 18' ' ' VAL . 89.2 t -121.7 123.93 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.019 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 14' ' ' VAL . . . . . 0.444 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 2.6 p -139.21 123.25 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.032 0.933 . . . . 0.0 108.884 -177.863 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 60.77 22.49 12.48 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.276 1.03 . . . . 0.0 112.455 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.31 -8.15 77.61 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.878 -0.401 . . . . 0.0 113.994 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 15.0 ptpt -94.93 171.58 8.68 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.568 HG11 ' HE ' ' A' ' 11' ' ' ARG . 99.1 t -117.69 126.3 74.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 174.89 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.581 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 36.7 mt-10 -106.82 157.09 18.01 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.576 0.703 . . . . 0.0 109.721 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -126.61 127.44 45.23 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.441 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -77.06 108.85 10.43 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.472 HD22 HG21 ' A' ' 5' ' ' VAL . 49.8 mt -81.78 172.79 12.95 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.061 0.851 . . . . 0.0 111.102 -174.648 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -126.46 100.97 6.48 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.531 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 84.6 m95 -69.57 116.63 10.19 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.754 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -73.1 114.32 11.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 123.778 0.674 . . . . 0.0 110.173 -171.599 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 118.13 -29.26 6.56 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 -174.17 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -98.05 157.81 15.91 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.214 1.005 . . . . 0.0 111.256 179.084 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' THR . . . . . 0.404 HG23 ' H ' ' A' ' 31' ' ' ASP . 9.1 t -74.26 160.77 30.66 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.598 178.714 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.475 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.7 m-20 -70.0 -19.04 63.35 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.147 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.02 -31.54 66.29 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.868 0.867 . . . . 0.0 110.578 173.308 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.404 ' H ' HG23 ' A' ' 28' ' ' THR . 27.7 t70 -78.79 -30.7 45.65 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.366 0.666 . . . . 0.0 110.978 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.531 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.0 m120 -61.46 148.75 40.83 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.846 0.716 . . . . 0.0 112.423 -172.746 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.3 p -126.57 163.8 22.61 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.772 0.829 . . . . 0.0 111.286 -167.779 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.3 119.73 25.41 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 170.632 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -119.56 132.71 23.92 Favored Pre-proline 0 C--O 1.239 0.511 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 172.125 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.581 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 48.2 Cg_endo -67.11 160.0 49.46 Favored 'Trans proline' 0 C--N 1.366 1.455 0 C-N-CA 122.161 1.907 . . . . 0.0 112.333 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -55.69 -28.22 54.38 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.025 1.33 . . . . 0.0 112.204 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.473 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.0 pt-20 -75.5 -17.72 60.03 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.056 1.342 . . . . 0.0 111.731 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -107.97 -4.77 17.57 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.199 0.599 . . . . 0.0 111.331 -169.636 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.567 HD12 HD11 ' A' ' 46' ' ' ILE . 30.7 mt -87.05 158.2 19.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.15 0.58 . . . . 0.0 110.861 -177.49 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.54 9.76 25.23 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 166.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 23.0 p -117.43 90.61 35.28 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 123.069 0.548 . . . . 0.0 111.527 -172.663 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.75 -22.14 10.63 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.314 2.01 . . . . 0.0 111.079 166.319 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.28 -44.31 83.91 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.246 1.018 . . . . 0.0 111.593 177.556 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.81 -29.18 55.87 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.982 0.513 . . . . 0.0 110.963 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.567 HD11 HD12 ' A' ' 40' ' ' LEU . 72.0 mt -63.48 -54.28 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 172.088 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.51 -46.14 89.78 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.692 -176.843 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.2 90.2 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 123.747 0.655 . . . . 0.0 110.766 -177.974 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.45 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 82.8 t80 -58.78 -48.5 81.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.044 0.538 . . . . 0.0 109.952 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.3 mt -65.56 -27.6 68.55 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.498 0.719 . . . . 0.0 111.557 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -82.5 -19.64 38.35 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.582 0.753 . . . . 0.0 111.981 175.412 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.5 m -83.07 -55.06 4.59 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.691 0.396 . . . . 0.0 110.321 177.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' ' 49' ' ' PHE . 0.0 OUTLIER -78.15 -24.1 47.44 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.68 0.392 . . . . 0.0 111.806 -179.407 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.1 mtmm . . . . . 0 N--CA 1.484 1.272 0 C-N-CA 124.599 1.16 . . . . 0.0 111.817 175.235 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 121.043 0.449 . . . . 0.0 109.951 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -139.45 109.35 6.35 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.562 0.745 . . . . 0.0 109.466 177.598 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 12.2 p -113.44 135.82 53.45 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 123.574 0.749 . . . . 0.0 109.967 176.307 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 4' ' ' LYS . . . . . 0.617 ' HB2' HG21 ' A' ' 4' ' ' VAL . 21.4 pttm -103.62 80.67 1.81 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 122.031 0.919 . . . . 0.0 108.612 174.674 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -78.99 145.36 33.97 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.789 -175.189 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 76.1 p -99.33 177.71 5.11 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.016 0.912 . . . . 0.0 112.532 -171.828 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -163.84 156.36 17.64 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.267 174.177 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.444 ' HD3' ' HG3' ' A' ' 2' ' ' GLU . 14.1 tpt180 -97.41 146.15 25.48 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.249 0.62 . . . . 0.0 109.673 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.513 0 C-N-CA 123.153 0.581 . . . . 0.0 109.858 169.738 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 36.9 t -56.0 93.31 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.957 0.903 . . . . 0.0 110.904 -178.066 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 2.9 t -74.17 84.5 1.85 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.498 1.119 . . . . 0.0 111.005 -173.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 70.02 -86.03 0.3 Allowed Glycine 0 C--N 1.345 1.054 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.727 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 77.06 -67.02 2.78 Favored Glycine 0 C--N 1.354 1.528 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 -171.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -158.06 93.36 1.24 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.703 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 C-N-CA 123.842 0.857 . . . . 0.0 109.465 -172.914 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.469 0 N-CA-C 111.799 -0.521 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -90.25 94.34 9.72 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.332 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -93.98 157.73 15.96 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.871 -177.798 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.4 p -80.53 123.82 37.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-O 121.468 0.651 . . . . 0.0 109.562 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.513 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -102.97 133.45 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.412 1.085 . . . . 0.0 109.358 175.547 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.622 ' HB2' ' HG3' ' A' ' 25' ' ' LYS . 34.3 tt0 -69.55 -49.15 57.02 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.474 0.71 . . . . 0.0 111.01 176.585 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HA ' HD22 ' A' ' 45' ' ' LEU . 21.1 ptmt -166.61 164.92 16.93 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.633 0.583 . . . . 0.0 111.607 -173.937 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.537 HG11 ' HD2' ' A' ' 20' ' ' TYR . 94.7 t -85.51 135.76 24.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.475 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.0 mt -100.48 -43.64 6.15 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.736 0.814 . . . . 0.0 110.137 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -148.92 164.86 33.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.343 -171.076 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.507 ' HE ' HG11 ' A' ' 18' ' ' VAL . 34.9 ttt180 -138.72 128.59 25.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.068 0.947 . . . . 0.0 109.485 -175.878 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 12' ' ' ARG . 3.0 ptm180 -124.41 162.31 24.15 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.934 0.894 . . . . 0.0 109.35 175.987 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -126.31 112.45 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.966 0.906 . . . . 0.0 108.768 177.63 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.0 m -120.45 125.2 73.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.113 0.965 . . . . 0.0 109.401 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 61.61 20.84 11.63 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.226 1.01 . . . . 0.0 112.108 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.8 -24.04 32.76 Favored Glycine 0 C--N 1.348 1.211 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.448 -176.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.8 ptmt -82.54 163.35 21.58 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.507 HG11 ' HE ' ' A' ' 11' ' ' ARG . 45.9 t -117.6 127.11 75.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 123.312 0.645 . . . . 0.0 110.186 -176.382 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.569 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 45.1 mt-10 -109.19 154.05 22.92 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.599 0.76 . . . . 0.0 109.586 170.504 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.537 ' HD2' HG11 ' A' ' 8' ' ' VAL . 63.8 m-85 -128.04 128.51 45.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.435 1.094 . . . . 0.0 108.669 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -78.51 107.89 11.49 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.2 mt -92.84 119.86 32.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.345 -171.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -75.87 93.33 3.18 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 167.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.626 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 87.1 m95 -68.51 134.79 50.6 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 178.483 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.622 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 26.4 mttm -67.64 134.23 50.79 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.863 0.727 . . . . 0.0 110.19 172.537 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.19 -33.95 4.12 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.842 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.427 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 79.7 m-85 -91.43 149.48 21.69 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.048 0.939 . . . . 0.0 110.509 -177.146 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 p -70.54 160.98 31.47 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.934 0.894 . . . . 0.0 111.795 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ASP . . . . . 0.472 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 p-10 -65.54 -29.94 70.62 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.341 1.057 . . . . 0.0 111.872 -177.406 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.8 -27.02 57.78 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.541 0.736 . . . . 0.0 111.19 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -89.04 -11.96 42.67 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.65 0.78 . . . . 0.0 110.83 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.626 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -64.26 143.07 58.16 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 122.529 0.332 . . . . 0.0 110.479 174.668 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 34.2 p -132.94 160.85 35.87 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.191 0.596 . . . . 0.0 111.876 -168.427 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -82.24 122.23 27.65 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.78 173.873 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -121.08 130.18 24.96 Favored Pre-proline 0 C--O 1.239 0.533 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 171.989 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.569 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 23.6 Cg_endo -61.22 162.04 21.19 Favored 'Trans proline' 0 C--N 1.371 1.758 0 C-N-CA 122.339 2.026 . . . . 0.0 112.31 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -55.02 -26.32 36.42 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 125.555 1.542 . . . . 0.0 113.153 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -77.65 -28.22 51.2 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.825 1.25 . . . . 0.0 111.989 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.6 m-20 -77.63 -21.87 51.62 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.525 0.73 . . . . 0.0 111.517 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.0 mt -73.28 117.48 15.07 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 122.886 0.474 . . . . 0.0 110.412 -176.624 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -94.78 -3.84 48.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.391 0.676 . . . . 0.0 110.204 172.382 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 16.3 p -101.01 98.0 7.91 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.618 1.167 . . . . 0.0 110.893 -176.08 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -76.22 -25.19 10.27 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.623 2.215 . . . . 0.0 112.191 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -59.3 -47.99 83.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.549 1.14 . . . . 0.0 110.916 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 7' ' ' LYS . 91.7 mt -70.36 -34.49 72.67 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.656 -177.084 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.6 mt -66.0 -51.01 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.88 -51.41 69.81 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.932 0.893 . . . . 0.0 111.025 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.93 79.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.565 0.746 . . . . 0.0 112.23 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -71.77 -54.44 10.22 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 122.722 0.409 . . . . 0.0 110.489 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.94 -37.68 79.01 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.516 0.726 . . . . 0.0 112.208 -171.112 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -81.55 -16.77 50.67 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.682 0.393 . . . . 0.0 111.564 -177.238 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 t -76.26 -15.71 59.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 122.528 0.331 . . . . 0.0 110.824 175.723 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.7 mt-30 -74.72 -52.63 11.04 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 123.595 0.758 . . . . 0.0 110.166 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.7 pttt . . . . . 0 CA--C 1.561 1.39 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.708 179.449 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -116.56 -12.2 10.99 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.367 1.067 . . . . 0.0 110.764 173.843 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 15.0 p -56.7 123.6 15.51 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 123.615 0.766 . . . . 0.0 110.718 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -62.58 111.82 2.22 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 177.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -80.9 74.71 7.87 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.782 0.801 . . . . 0.0 109.187 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.6 m -104.44 153.47 21.07 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 113.885 -1.507 . . . . 0.0 108.971 -176.649 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.09 140.24 17.5 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.383 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 15.1 ttt85 -82.27 137.64 34.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.637 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.683 0 O-C-N 122.083 -0.386 . . . . 0.0 110.299 170.232 . . . . . . . . 0 0 . 1 . 017 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 67.3 m -70.82 -12.79 61.76 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.423 0.689 . . . . 0.0 111.276 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 4.4 t -145.92 94.55 2.5 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 122.078 0.942 . . . . 0.0 110.023 175.367 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.07 56.56 1.53 Allowed Glycine 0 C--N 1.342 0.908 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 168.369 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 97.62 -170.76 25.72 Favored Glycine 0 C--N 1.345 1.046 0 CA-C-N 114.69 -0.755 . . . . 0.0 111.302 -167.298 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -141.97 155.55 45.46 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.449 0.7 . . . . 0.0 110.115 -178.225 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.08 0.952 . . . . 0.0 109.995 -176.092 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.65 0 N-CA-C 112.718 -0.153 . . . . 0.0 112.718 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -89.73 122.97 33.33 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 173.924 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -135.26 156.83 48.32 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.099 0.96 . . . . 0.0 109.322 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 3.7 p -69.61 109.84 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.96 0.886 . . . . 0.0 111.193 176.226 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.473 HG21 HD22 ' A' ' 22' ' ' LEU . 1.7 p -76.85 140.5 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.223 171.082 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' GLU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 35.1 tt0 -68.31 -59.51 3.14 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.408 0.683 . . . . 0.0 110.162 176.356 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -166.41 164.87 17.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.598 -176.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.458 HG23 ' HB3' ' A' ' 45' ' ' LEU . 91.6 t -83.72 137.3 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.089 0.955 . . . . 0.0 108.969 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.5 mt -110.01 -29.58 8.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.354 0.661 . . . . 0.0 110.805 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -160.31 165.33 31.5 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.691 0.396 . . . . 0.0 110.65 -173.306 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.2 ttt180 -139.01 134.86 33.61 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.109 1.364 . . . . 0.0 109.754 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -134.04 175.69 9.25 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.534 1.134 . . . . 0.0 109.493 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -125.23 114.67 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.594 0.758 . . . . 0.0 109.654 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 73.3 t -126.85 131.76 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 173.558 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 70.63 14.52 7.2 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.714 1.259 . . . . 0.0 110.924 -177.315 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.0 9.29 86.84 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 116.184 -0.462 . . . . 0.0 113.074 -173.688 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.25 155.54 23.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 56.2 t -96.4 119.98 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.72 0.808 . . . . 0.0 109.632 -171.284 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.644 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.6 mt-10 -119.56 138.5 53.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.417 0.687 . . . . 0.0 110.017 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -113.93 132.33 55.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.1 0.96 . . . . 0.0 110.25 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -78.12 107.82 10.97 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.473 HD22 HG21 ' A' ' 5' ' ' VAL . 39.9 mt -97.74 122.41 40.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.352 -171.249 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.5 tmtt? -79.89 113.69 18.24 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 161.169 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.7 m95 -82.75 139.02 33.84 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.119 0.568 . . . . 0.0 110.005 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LYS . . . . . 0.522 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 59.2 tttp -62.67 -59.2 5.23 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.563 0.745 . . . . 0.0 112.009 -166.76 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.29 29.07 6.28 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 113.649 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.552 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 88.7 m-85 -135.69 167.37 21.27 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.407 1.083 . . . . 0.0 109.836 174.925 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.4 p -82.8 171.81 13.54 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.509 0.724 . . . . 0.0 111.869 -175.507 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -70.26 -30.23 67.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.604 0.762 . . . . 0.0 110.98 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.85 60.64 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.546 0.738 . . . . 0.0 111.101 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ASP . . . . . 0.411 ' OD2' HM21 ' B' ' 9' ' ' M3L . 10.9 t70 -94.59 10.89 33.02 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.396 -177.539 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.8 142.83 57.22 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.095 0.958 . . . . 0.0 111.662 174.848 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.9 p -141.33 155.61 45.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.609 0.764 . . . . 0.0 110.976 -176.031 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -87.29 111.26 20.87 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.787 0.835 . . . . 0.0 110.912 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -117.73 126.96 26.95 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.644 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.9 Cg_endo -67.01 157.22 62.8 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 122.497 2.131 . . . . 0.0 112.886 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -30.63 61.71 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.575 1.15 . . . . 0.0 112.885 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -67.43 -33.89 76.09 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.642 0.734 . . . . 0.0 110.346 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.404 ' OD1' ' HB3' ' B' ' 8' ' ' ARG . 60.1 t30 -89.5 -18.92 25.75 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.854 1.262 . . . . 0.0 110.833 -175.229 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.566 HD12 HD11 ' A' ' 46' ' ' ILE . 23.3 mt -70.51 162.73 28.26 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.784 0.434 . . . . 0.0 110.655 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -137.07 34.21 2.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 24.4 p -147.76 95.01 4.29 Favored Pre-proline 0 C--N 1.355 0.818 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.497 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.86 -16.11 18.54 Favored 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.234 1.956 . . . . 0.0 111.323 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -60.5 -43.8 96.65 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.457 1.103 . . . . 0.0 111.218 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' LEU . . . . . 0.468 HD21 ' HG3' ' B' ' 5' ' ' GLN . 69.6 mt -72.95 -44.59 60.97 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.865 0.466 . . . . 0.0 111.787 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.566 HD11 HD12 ' A' ' 40' ' ' LEU . 63.4 mt -60.94 -45.16 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 123.819 0.699 . . . . 0.0 110.536 -176.783 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.51 -52.99 58.85 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.339 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.32 -32.5 66.77 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.696 0.798 . . . . 0.0 112.216 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -67.29 -42.95 82.91 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.647 1.179 . . . . 0.0 110.684 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 90.2 mt -75.84 -32.34 59.74 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.162 0.585 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.2 m-20 -74.42 -26.68 60.22 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.277 1.031 . . . . 0.0 110.271 -179.192 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t -65.08 -33.21 75.49 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.842 0.857 . . . . 0.0 110.293 173.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -75.66 -29.22 59.02 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.985 0.914 . . . . 0.0 111.245 -177.896 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? . . . . . 0 C--O 1.251 1.178 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.444 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.21 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 41.3 mmt180 64.62 15.45 9.7 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 125.156 1.382 . . . . 0.0 112.868 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 17.0 m 55.88 75.95 0.31 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.617 1.167 . . . . 0.0 110.722 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -109.16 89.76 3.09 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.345 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.468 ' HG3' HD21 ' A' ' 45' ' ' LEU . 16.5 pm0 -110.54 104.43 13.15 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-O 121.901 0.858 . . . . 0.0 109.373 -172.911 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 6' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 14.8 p -113.29 169.39 8.98 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.173 0.989 . . . . 0.0 111.133 -175.988 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.47 159.28 19.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 123.79 0.836 . . . . 0.0 109.176 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 8' ' ' ARG . . . . . 0.404 ' HB3' ' OD1' ' A' ' 39' ' ' ASN . 32.8 ttm-85 -111.33 163.14 14.29 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -175.95 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.411 HM21 ' OD2' ' A' ' 31' ' ' ASP . . . . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 179.166 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 39.6 p -173.82 118.62 0.27 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.875 0.87 . . . . 0.0 109.172 175.778 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 35.8 m -55.42 -48.98 73.57 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.028 0.931 . . . . 0.0 110.452 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.78 77.21 2.14 Favored Glycine 0 CA--C 1.53 0.969 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 167.424 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.92 77.24 1.14 Allowed Glycine 0 C--N 1.355 1.619 0 C-N-CA 123.891 0.757 . . . . 0.0 112.463 -176.092 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -153.17 151.59 30.3 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.384 1.074 . . . . 0.0 109.717 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.215 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 178.917 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.647 0 N-CA-C 111.961 -0.456 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -73.94 -49.01 26.61 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.717 0.259 . . . . 0.0 111.64 -175.581 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -119.49 115.32 23.81 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.412 0.625 . . . . 0.0 109.377 175.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.2 p -83.81 135.91 23.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.607 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' VAL . . . . . 0.507 HG21 ' HG ' ' A' ' 22' ' ' LEU . 1.5 p -112.99 130.7 66.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.77 -63.87 1.01 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.252 1.021 . . . . 0.0 110.171 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -165.05 169.68 16.0 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.767 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.593 HG11 ' HD2' ' A' ' 20' ' ' TYR . 99.8 t -83.08 144.64 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.815 171.631 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.44 -31.63 7.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.754 0.822 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -154.23 161.84 41.56 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -176.047 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' ARG . . . . . 0.411 HH21 HG11 ' A' ' 18' ' ' VAL . 47.9 ttt180 -133.76 141.37 47.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.471 0.708 . . . . 0.0 109.223 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -148.25 171.43 15.97 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.955 0.502 . . . . 0.0 110.4 178.33 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -119.79 120.82 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 123.76 0.824 . . . . 0.0 109.216 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.1 t -131.62 126.49 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.21 1.004 . . . . 0.0 108.703 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.5 m120 67.23 18.06 10.31 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.938 1.295 . . . . 0.0 111.267 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.56 -18.05 48.66 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.561 -172.881 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -78.26 162.71 26.34 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.622 0.769 . . . . 0.0 110.128 -177.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' VAL . . . . . 0.411 HG11 HH21 ' A' ' 11' ' ' ARG . 82.4 t -107.81 106.93 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 0.0 109.391 -175.413 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.562 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 89.8 mt-10 -105.14 152.86 22.29 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.327 0.651 . . . . 0.0 111.225 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.593 ' HD2' HG11 ' A' ' 8' ' ' VAL . 92.3 m-85 -132.53 136.5 46.67 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.074 1.35 . . . . 0.0 107.777 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -79.59 105.77 11.14 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 174.434 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.548 HD21 HD22 ' A' ' 40' ' ' LEU . 10.2 mp -86.88 113.53 22.75 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.398 0.679 . . . . 0.0 110.777 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtm? -72.84 97.65 2.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 168.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.575 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 83.6 m95 -65.1 123.43 19.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 174.808 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -64.95 115.49 5.43 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.398 1.061 . . . . 0.0 110.612 -172.905 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.08 -4.05 67.39 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 115.667 -0.697 . . . . 0.0 113.475 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.424 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 96.4 m-85 -109.7 142.25 41.15 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.964 0.905 . . . . 0.0 110.073 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 t -62.37 152.45 34.0 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.775 0.83 . . . . 0.0 111.643 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.84 -23.28 64.23 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.903 0.881 . . . . 0.0 112.747 -172.341 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.82 -31.16 64.6 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.902 0.481 . . . . 0.0 110.634 173.097 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -80.08 -30.2 39.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.706 0.802 . . . . 0.0 111.196 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.575 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -61.46 143.36 56.02 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.215 0.606 . . . . 0.0 111.195 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.9 p -126.97 169.28 13.48 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.206 0.602 . . . . 0.0 112.268 -164.093 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -88.25 114.66 25.09 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.743 0.817 . . . . 0.0 109.854 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.471 ' HB2' HD13 ' A' ' 22' ' ' LEU . 72.8 mm-40 -117.98 131.45 24.15 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 123.441 0.696 . . . . 0.0 109.766 173.759 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.562 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 67.8 Cg_endo -72.09 153.93 57.38 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 122.188 1.925 . . . . 0.0 112.18 174.489 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -30.68 63.37 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.192 0.997 . . . . 0.0 112.178 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.527 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 16.2 pt-20 -70.8 -8.81 55.17 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.397 1.079 . . . . 0.0 111.477 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -115.6 -7.28 12.19 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.159 0.983 . . . . 0.0 110.72 -174.942 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.548 HD22 HD21 ' A' ' 22' ' ' LEU . 14.1 mt -86.73 143.09 27.71 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.036 0.534 . . . . 0.0 112.04 -175.837 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -93.12 -6.45 47.97 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.048 0.539 . . . . 0.0 110.305 172.013 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' CYS . . . . . 0.548 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 21.2 p -107.15 98.47 22.4 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -175.908 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.9 -27.35 8.69 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.339 2.026 . . . . 0.0 111.666 173.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -61.21 -47.12 87.6 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 123.766 0.827 . . . . 0.0 111.154 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.13 -29.65 65.51 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.26 0.624 . . . . 0.0 111.762 -175.5 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.402 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 72.6 mt -66.19 -54.12 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.566 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -54.56 -53.51 53.52 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.326 1.05 . . . . 0.0 109.671 176.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -33.09 74.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.792 -168.106 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -65.86 -50.38 64.78 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.437 0.461 . . . . 0.0 110.246 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 72.6 mt -62.92 -32.13 73.35 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.841 0.713 . . . . 0.0 110.247 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -71.31 -39.33 71.51 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.825 1.25 . . . . 0.0 109.463 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.8 t -70.65 -27.73 64.27 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.299 -177.743 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.9 mt-30 -61.35 -29.3 69.81 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.712 0.405 . . . . 0.0 110.182 175.291 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' LYS . . . . . 0.469 ' NZ ' ' HA ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.144 0 C-N-CA 123.173 0.589 . . . . 0.0 109.737 174.376 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -112.59 -65.71 1.15 Allowed 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 27.2 p -104.34 157.34 17.21 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.35 1.06 . . . . 0.0 109.848 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -88.66 102.85 15.38 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.744 0.818 . . . . 0.0 110.631 -177.921 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 5' ' ' GLN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 2.5 mp0 -77.5 80.46 3.99 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.822 0.849 . . . . 0.0 110.985 177.685 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 35.4 p -142.67 176.31 9.14 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 124.041 0.937 . . . . 0.0 109.338 178.885 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -166.26 174.4 9.2 Favored 'General case' 0 C--O 1.261 1.686 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.112 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -128.26 131.89 48.74 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.582 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 -176.72 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 25.6 t -68.11 94.33 0.49 Allowed 'General case' 0 C--O 1.241 0.621 0 O-C-N 124.052 0.845 . . . . 0.0 109.533 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 13.2 t -70.71 -17.75 62.82 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.597 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 113.77 160.44 13.75 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 -176.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 78.7 25.51 60.43 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 -177.315 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -87.12 89.79 8.12 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.861 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.556 1.189 0 C-N-CA 123.85 0.86 . . . . 0.0 109.152 177.096 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.54 0 N-CA-C 112.135 -0.386 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -77.76 148.06 35.02 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.525 0.73 . . . . 0.0 109.408 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -89.0 116.2 27.12 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.7 p -74.64 125.47 34.11 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.397 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.3 p -107.19 134.92 47.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.642 -177.025 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.95 -58.15 5.52 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.543 1.137 . . . . 0.0 110.547 177.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -164.17 167.24 20.34 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.883 -170.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' VAL . . . . . 0.439 HG13 ' HB3' ' A' ' 20' ' ' TYR . 65.2 t -94.18 141.5 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 169.008 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.4 mt -109.44 -38.39 5.48 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.076 0.95 . . . . 0.0 111.075 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -157.85 164.39 37.0 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.921 0.489 . . . . 0.0 110.218 -172.597 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -130.88 138.83 49.99 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.657 1.183 . . . . 0.0 110.045 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -132.88 163.04 30.01 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.281 1.032 . . . . 0.0 109.102 174.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.0 t -130.87 109.07 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 171.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 m -118.78 125.2 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.192 0.997 . . . . 0.0 110.6 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 58.51 25.99 13.75 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.658 1.183 . . . . 0.0 112.281 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.02 -16.87 58.53 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.286 -178.269 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' LYS . . . . . 0.406 ' HD2' ' HB3' ' A' ' 36' ' ' PRO . 6.3 ttpp -84.04 149.64 26.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.048 0.939 . . . . 0.0 109.42 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.8 t -115.98 114.44 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.82 0.848 . . . . 0.0 109.307 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' GLU . . . . . 0.663 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 40.4 mt-10 -110.43 155.23 22.49 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.154 0.502 . . . . 0.0 110.708 -179.284 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HB3' HG13 ' A' ' 8' ' ' VAL . 96.7 m-85 -128.36 130.23 47.42 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.246 1.018 . . . . 0.0 109.059 -177.924 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.67 107.39 11.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' LEU . . . . . 0.477 HD11 HD22 ' A' ' 40' ' ' LEU . 39.1 mt -95.87 129.48 43.11 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 122.843 0.457 . . . . 0.0 111.083 -171.898 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 23' ' ' LYS . . . . . 0.471 ' HG2' HD21 ' A' ' 32' ' ' ASN . 5.7 tmtm? -84.02 115.54 22.4 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 162.862 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' TRP . . . . . 0.553 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 82.1 m95 -79.71 130.37 35.29 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.725 0.41 . . . . 0.0 109.959 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -67.76 -46.13 72.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.188 0.595 . . . . 0.0 111.792 -167.96 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.17 20.36 50.48 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.409 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 86.6 m-85 -140.0 171.27 14.43 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.761 0.824 . . . . 0.0 111.152 -176.935 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.1 p -80.47 172.02 14.3 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.961 0.904 . . . . 0.0 112.777 -174.691 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.67 -27.67 63.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.434 1.094 . . . . 0.0 111.445 176.355 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.05 -22.72 62.09 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.207 0.603 . . . . 0.0 110.953 175.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -85.34 -20.15 30.39 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.283 1.033 . . . . 0.0 110.927 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' ASN . . . . . 0.471 HD21 ' HG2' ' A' ' 23' ' ' LYS . 11.0 m-20 -48.87 121.69 4.95 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.364 1.066 . . . . 0.0 111.643 176.155 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.46 158.13 45.16 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.268 0.627 . . . . 0.0 112.003 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -81.4 113.09 19.25 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.568 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' GLU . . . . . 0.471 ' HB2' HD21 ' A' ' 40' ' ' LEU . 46.3 mm-40 -117.43 129.07 25.59 Favored Pre-proline 0 CA--C 1.544 0.714 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.323 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 36' ' ' PRO . . . . . 0.663 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.6 Cg_endo -66.57 159.0 52.86 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 122.526 2.151 . . . . 0.0 113.287 177.058 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 37' ' ' GLU . . . . . 0.425 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -63.19 -28.31 69.96 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.654 0.781 . . . . 0.0 112.323 -177.532 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 38' ' ' GLU . . . . . 0.529 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.0 pt-20 -68.36 -20.68 64.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.156 0.982 . . . . 0.0 111.27 175.186 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 39' ' ' ASN . . . . . 0.57 HD21 ' HA ' ' B' ' 9' ' ' M3L . 67.2 t30 -103.91 -7.17 20.64 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.618 1.167 . . . . 0.0 110.293 -175.056 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.477 HD22 HD11 ' A' ' 22' ' ' LEU . 18.5 mt -89.51 137.31 32.44 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.206 0.602 . . . . 0.0 110.838 178.433 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -100.07 -3.01 32.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.39 0.676 . . . . 0.0 109.438 170.495 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.7 p -106.57 91.75 6.35 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.141 0.976 . . . . 0.0 110.618 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.31 -14.28 4.89 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.423 2.082 . . . . 0.0 112.501 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -70.44 -44.11 68.5 Favored 'General case' 0 C--O 1.215 -0.744 0 C-N-CA 123.825 0.85 . . . . 0.0 109.843 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.21 -33.59 76.37 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.509 0.724 . . . . 0.0 111.01 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 75.2 mt -64.41 -55.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 174.173 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.26 -45.49 80.06 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.091 0.956 . . . . 0.0 111.326 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.11 -42.39 99.17 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.237 1.015 . . . . 0.0 110.802 -177.476 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 49' ' ' PHE . . . . . 0.427 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 59.8 t80 -60.31 -50.48 73.46 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.694 174.577 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 50' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 81.5 mt -62.06 -36.49 81.8 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.802 0.841 . . . . 0.0 111.255 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -74.32 -40.09 62.44 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 110.39 179.8 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.0 m -80.51 2.08 26.8 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.342 0.657 . . . . 0.0 112.563 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 49' ' ' PHE . 77.2 mt-30 -69.56 -54.42 14.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 170.52 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.9 mptt . . . . . 0 C--O 1.249 1.058 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.132 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.841 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' B' B ' 2' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' B' ' 2' ' ' ARG . 0.0 OUTLIER -88.36 76.13 8.38 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 174.588 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 22.7 m -96.49 100.12 11.73 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.965 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -123.87 -21.61 5.09 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.618 0.767 . . . . 0.0 109.988 167.995 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -79.74 77.83 6.35 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.934 0.873 . . . . 0.0 110.148 -177.928 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 36.3 p -126.28 177.56 6.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.321 -1.308 . . . . 0.0 109.861 -177.039 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.93 171.83 16.17 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.134 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -128.2 171.49 11.9 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 -174.015 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 9' ' ' M3L . . . . . 0.57 ' HA ' HD21 ' A' ' 39' ' ' ASN . . . . . . . . 0 N--CA 1.488 1.429 0 C-N-CA 122.729 0.412 . . . . 0.0 111.994 176.719 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 29.3 t -167.86 100.19 0.47 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 175.296 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 28.3 m -50.43 -38.32 42.64 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.802 1.241 . . . . 0.0 111.546 177.951 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.41 -57.47 0.19 Allowed Glycine 0 C--N 1.339 0.742 0 N-CA-C 110.359 -1.096 . . . . 0.0 110.359 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 145.28 67.07 0.02 OUTLIER Glycine 0 C--N 1.343 0.943 0 N-CA-C 111.422 -0.671 . . . . 0.0 111.422 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -70.66 93.61 0.94 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 176.94 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 C-N-CA 124.358 1.063 . . . . 0.0 109.737 -177.039 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 . . . . . 0 N--CA 1.47 0.57 0 CA-C-O 120.795 0.331 . . . . 0.0 110.24 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.3 p -78.5 119.67 27.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.7 0 C-N-CA 123.153 0.581 . . . . 0.0 110.354 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.475 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.5 p -93.24 137.55 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.566 172.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.15 -51.5 8.9 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.614 0.766 . . . . 0.0 110.829 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -161.25 169.45 22.16 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.671 0.607 . . . . 0.0 111.511 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.416 HG11 ' HD2' ' A' ' 20' ' ' TYR . 58.6 t -100.19 143.12 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.286 172.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.437 HD12 HD22 ' A' ' 32' ' ' ASN . 72.4 mt -108.52 -39.2 5.47 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.218 1.007 . . . . 0.0 111.429 178.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -154.02 166.4 33.13 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 122.755 0.422 . . . . 0.0 110.957 -174.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.575 HH11 HD21 ' A' ' 50' ' ' LEU . 53.5 ttt180 -142.2 148.73 38.67 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.738 1.215 . . . . 0.0 110.36 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -152.36 174.56 13.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.723 1.209 . . . . 0.0 109.25 173.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.586 HG22 HG22 ' A' ' 18' ' ' VAL . 94.6 t -123.11 116.03 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.667 0.787 . . . . 0.0 109.796 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -118.56 121.24 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.074 0.949 . . . . 0.0 109.369 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 64.05 23.6 13.29 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.86 1.264 . . . . 0.0 112.252 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.51 -23.35 32.64 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.444 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.89 157.33 24.39 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.942 0.897 . . . . 0.0 109.116 176.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.586 HG22 HG22 ' A' ' 13' ' ' VAL . 99.4 t -113.08 114.29 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.476 0.71 . . . . 0.0 109.438 -173.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.54 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -109.39 134.37 51.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.631 0.773 . . . . 0.0 110.562 -177.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.416 ' HD2' HG11 ' A' ' 8' ' ' VAL . 48.8 m-85 -108.77 128.46 54.9 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.055 0.942 . . . . 0.0 109.774 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.92 108.37 9.92 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 32' ' ' ASN . 57.8 mt -82.8 -174.71 5.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.547 0.689 . . . . 0.0 112.236 -171.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -144.71 112.91 6.47 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 103.947 -2.612 . . . . 0.0 103.947 163.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 87.5 m95 -79.03 147.75 32.73 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.012 0.434 . . . . 0.0 111.411 -173.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -85.1 -36.21 21.3 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.506 172.525 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -73.19 -28.98 65.17 Favored Glycine 0 C--N 1.357 1.696 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.317 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -120.43 171.91 8.19 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.769 0.828 . . . . 0.0 110.956 -174.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.6 p -70.65 161.78 30.14 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 123.182 0.593 . . . . 0.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.72 -27.09 65.63 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.4 0.68 . . . . 0.0 112.109 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.46 -19.02 34.05 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.449 0.7 . . . . 0.0 111.263 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.53 1.62 41.05 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.37 0.668 . . . . 0.0 110.886 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.474 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 31.1 p-10 -56.96 146.98 25.1 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 124.368 1.067 . . . . 0.0 112.718 175.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 7.2 p -140.9 158.71 43.57 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.4 -173.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -76.95 115.95 17.19 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.111 0.965 . . . . 0.0 110.31 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -124.56 131.3 24.14 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.554 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . 63.8 Cg_endo -70.85 154.61 63.33 Favored 'Trans proline' 0 C--N 1.365 1.395 0 C-N-CA 122.439 2.092 . . . . 0.0 112.438 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -28.34 56.45 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.469 1.107 . . . . 0.0 112.289 178.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.554 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.3 pt-20 -66.27 -31.92 73.02 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 123.664 0.603 . . . . 0.0 111.279 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.403 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 3.1 m-20 -93.9 -18.47 21.93 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.942 0.897 . . . . 0.0 111.593 177.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.43 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 61.1 mt -76.75 124.86 28.31 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 176.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -103.48 23.82 12.0 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 171.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.508 ' HB3' ' HB3' ' B' ' 5' ' ' GLN . 21.3 p -112.52 89.67 13.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 123.942 0.897 . . . . 0.0 110.505 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -73.63 -33.02 7.08 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.888 2.392 . . . . 0.0 111.814 173.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.96 -50.21 73.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.559 -1.201 . . . . 0.0 111.418 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.422 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 77.8 mt -70.22 -36.84 74.83 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.599 -175.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.2 -49.7 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.803 0.441 . . . . 0.0 110.405 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.97 -50.63 72.72 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.573 0.546 . . . . 0.0 110.626 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.62 -38.76 85.81 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 124.056 0.848 . . . . 0.0 111.457 -176.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -64.06 -42.92 96.85 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.733 0.813 . . . . 0.0 111.508 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.575 HD21 HH11 ' A' ' 11' ' ' ARG . 84.2 mt -68.52 -35.46 77.5 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.092 0.557 . . . . 0.0 110.396 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -66.4 -31.34 72.04 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.136 0.974 . . . . 0.0 110.948 175.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m . . . . . 0 N--CA 1.476 0.847 0 C-N-CA 123.377 0.671 . . . . 0.0 110.833 177.276 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.508 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.7 mm-40 . . . . . 0 CA--C 1.532 0.276 0 N-CA-C 108.662 -0.866 . . . . 0.0 108.662 . . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 28.2 p -97.71 147.38 24.42 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.391 0.676 . . . . 0.0 111.215 -175.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.12 144.02 24.53 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.145 0.978 . . . . 0.0 109.845 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 16.1 mtp180 . . . . . 0 N--CA 1.469 0.498 0 C-N-CA 124.182 0.993 . . . . 0.0 108.69 -178.115 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.1 t80 . . . . . 0 CA--C 1.541 0.616 0 N-CA-C 109.394 -0.595 . . . . 0.0 109.394 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.42 109.71 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.544 0.738 . . . . 0.0 111.887 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.528 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.7 p -85.11 137.48 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 165.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -76.74 -54.64 6.36 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.199 0.6 . . . . 0.0 110.311 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.44 ' HA ' HD13 ' A' ' 45' ' ' LEU . 19.3 ptmt -160.28 164.94 32.23 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.001 0.52 . . . . 0.0 111.97 177.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.439 HG11 ' HD2' ' A' ' 20' ' ' TYR . 89.6 t -86.73 134.58 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.356 1.062 . . . . 0.0 109.614 171.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.2 mt -101.6 -39.15 7.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.507 0.723 . . . . 0.0 110.887 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -149.41 165.37 32.27 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.518 0.327 . . . . 0.0 110.696 -172.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -132.97 144.03 49.85 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.277 1.031 . . . . 0.0 109.154 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.34 172.44 15.38 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.778 0.831 . . . . 0.0 109.684 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 18' ' ' VAL . 76.5 t -127.5 121.95 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.302 1.041 . . . . 0.0 108.976 175.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.468 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 69.2 t -129.38 125.79 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 63.96 20.0 12.01 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.412 1.085 . . . . 0.0 112.332 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.79 -12.86 62.63 Favored Glycine 0 C--N 1.348 1.244 0 CA-C-O 119.949 -0.362 . . . . 0.0 113.974 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptpt -98.4 165.32 11.9 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.404 0.602 . . . . 0.0 109.459 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 13' ' ' VAL . 56.5 t -107.96 119.37 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.12 0.568 . . . . 0.0 109.685 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.7 mt-10 -110.16 139.0 45.77 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.406 0.682 . . . . 0.0 110.211 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HD2' HG11 ' A' ' 8' ' ' VAL . 61.7 m-85 -111.57 140.68 45.98 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.659 0.784 . . . . 0.0 110.11 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -79.08 108.04 12.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.469 HD22 HG21 ' A' ' 5' ' ' VAL . 23.2 mt -95.37 120.47 35.67 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.115 0.566 . . . . 0.0 110.757 -174.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.757 ' HD3' ' HA ' ' A' ' 29' ' ' ASP . 0.0 OUTLIER -91.62 113.03 25.19 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 166.33 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.528 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 68.9 m95 -79.06 150.12 31.94 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.817 0.847 . . . . 0.0 111.03 -173.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -88.79 -39.37 13.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.944 0.498 . . . . 0.0 111.156 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.67 -33.37 60.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.217 177.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -94.03 162.44 13.88 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.398 0.679 . . . . 0.0 110.289 174.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.1 p -72.36 172.11 10.97 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.507 0.723 . . . . 0.0 111.631 -177.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.757 ' HA ' ' HD3' ' A' ' 23' ' ' LYS . 1.2 m-20 -69.44 -17.59 63.65 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.281 0.632 . . . . 0.0 110.919 173.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.75 -19.09 60.37 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.778 0.831 . . . . 0.0 111.7 173.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -121.78 85.36 2.4 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.634 0.731 . . . . 0.0 109.466 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.433 ' HB3' ' HA ' ' A' ' 23' ' ' LYS . 6.9 p30 -125.61 136.48 53.31 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.749 1.22 . . . . 0.0 110.179 173.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.2 p -130.85 154.79 47.68 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.656 0.783 . . . . 0.0 111.114 -173.375 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -80.84 123.68 28.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.967 0.907 . . . . 0.0 110.313 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -123.79 138.94 31.29 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 123.186 0.594 . . . . 0.0 109.563 171.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 60.9 Cg_endo -68.83 158.94 55.84 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 122.726 2.284 . . . . 0.0 112.302 175.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.463 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 11.3 pt-20 -65.74 -26.05 67.56 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.106 0.562 . . . . 0.0 111.615 -175.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.482 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.9 pt-20 -62.07 -32.19 72.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.959 0.904 . . . . 0.0 110.971 175.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.425 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 7.9 m-20 -80.09 -32.32 39.2 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.85 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.465 ' CD2' HD11 ' A' ' 22' ' ' LEU . 13.4 mt -72.27 131.97 43.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.055 -176.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -123.97 66.38 1.04 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.688 ' SG ' ' HG2' ' B' ' 5' ' ' GLN . 36.2 t -152.6 112.07 2.77 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 114.38 -1.282 . . . . 0.0 110.353 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -78.71 -23.54 8.14 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.125 1.883 . . . . 0.0 111.885 168.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -63.32 -58.7 6.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.987 0.915 . . . . 0.0 111.872 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.452 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 87.5 mt -72.18 -39.16 68.85 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.642 0.777 . . . . 0.0 112.285 -169.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.7 mt -65.41 -51.2 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 123.692 0.62 . . . . 0.0 110.406 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -66.0 -40.66 91.34 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.076 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.29 -37.06 86.01 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.832 0.453 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.13 -46.27 91.26 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.783 0.833 . . . . 0.0 110.534 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 82.2 mt -68.48 -37.22 79.95 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.145 -178.797 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -82.61 -14.86 54.05 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.635 0.774 . . . . 0.0 112.077 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 t . . . . . 0 N--CA 1.485 1.29 0 C-N-CA 123.171 0.588 . . . . 0.0 109.901 174.44 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.688 ' HG2' ' SG ' ' A' ' 42' ' ' CYS . 2.0 mp0 . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 109.887 -0.412 . . . . 0.0 109.887 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 54.1 m -72.06 117.78 14.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.449 1.1 . . . . 0.0 109.707 177.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.67 110.81 7.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.05 0.54 . . . . 0.0 109.918 176.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.425 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 39.6 ttt180 . . . . . 0 CA--C 1.536 0.431 0 C-N-CA 124.548 1.139 . . . . 0.0 111.085 177.503 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 . . . . . 0 N--CA 1.477 0.916 0 N-CA-C 110.378 -0.23 . . . . 0.0 110.378 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.47 HG13 ' O ' ' A' ' 25' ' ' LYS . 3.0 p -113.23 125.18 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 123.124 0.57 . . . . 0.0 110.658 -174.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.586 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.1 p -114.88 140.04 38.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 124.677 1.191 . . . . 0.0 110.405 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -73.24 -57.34 4.09 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.365 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.472 ' HA ' HD22 ' A' ' 45' ' ' LEU . 21.2 ptmt -164.2 162.57 22.76 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.307 0.575 . . . . 0.0 112.368 -174.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.528 HG23 ' HB3' ' A' ' 45' ' ' LEU . 93.3 t -84.3 143.7 11.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-N 114.649 -1.159 . . . . 0.0 108.857 169.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.54 -42.57 4.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.236 0.614 . . . . 0.0 110.577 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -151.77 164.86 36.1 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.84 0.456 . . . . 0.0 110.538 -171.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.4 ' HB2' ' HE2' ' A' ' 49' ' ' PHE . 77.3 ttt180 -124.18 159.54 29.87 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.415 1.086 . . . . 0.0 110.206 -174.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -159.43 167.09 29.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.634 0.774 . . . . 0.0 109.329 173.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -121.89 121.11 63.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.522 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 89.9 t -125.3 114.85 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.239 1.016 . . . . 0.0 109.041 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 65.78 12.06 8.05 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.329 1.051 . . . . 0.0 112.275 174.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 110.56 -25.04 16.06 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 123.315 0.484 . . . . 0.0 113.37 -174.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.8 ptpt -81.52 174.26 11.6 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 85.1 t -120.79 123.77 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.61 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 39.9 mt-10 -105.51 138.33 41.88 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.228 0.537 . . . . 0.0 110.341 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -111.84 136.66 50.83 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.548 1.139 . . . . 0.0 109.171 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -80.21 105.56 11.57 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.433 HD22 HG21 ' A' ' 5' ' ' VAL . 23.5 mt -91.62 112.63 24.63 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.512 -175.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 32' ' ' ASN . 0.1 OUTLIER -85.0 105.83 16.05 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 165.727 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.586 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 80.3 m95 -73.84 154.01 39.66 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.439 0.695 . . . . 0.0 112.039 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 4' ' ' VAL . 25.4 ttpp -112.14 151.41 29.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.1 -48.32 4.01 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -174.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -66.96 165.62 15.21 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.201 1.0 . . . . 0.0 109.584 165.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -65.75 152.43 44.32 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-O 120.812 0.339 . . . . 0.0 110.988 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.45 -31.56 70.95 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.764 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.38 -17.46 56.43 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.192 0.597 . . . . 0.0 111.597 176.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -84.59 65.32 8.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.856 0.862 . . . . 0.0 109.486 -178.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.563 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 16.2 p30 -111.03 149.08 31.24 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.006 1.322 . . . . 0.0 110.57 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 52.5 p -139.36 164.52 29.62 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.938 0.895 . . . . 0.0 110.476 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -86.15 123.78 31.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.72 133.69 24.99 Favored Pre-proline 0 N--CA 1.472 0.634 0 C-N-CA 122.818 0.447 . . . . 0.0 110.576 172.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.61 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 43.7 Cg_endo -65.77 160.61 42.88 Favored 'Trans proline' 0 C--N 1.366 1.485 0 C-N-CA 122.572 2.181 . . . . 0.0 112.384 176.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -25.47 65.58 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.62 1.168 . . . . 0.0 112.021 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.437 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 13.0 pt-20 -68.68 -23.02 64.34 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -89.98 -22.58 21.85 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.689 1.195 . . . . 0.0 111.488 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.421 ' CD2' HD11 ' A' ' 22' ' ' LEU . 21.1 mt -77.79 117.0 18.74 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.901 0.48 . . . . 0.0 111.426 -172.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.29 -27.56 27.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.508 ' SG ' ' HG ' ' A' ' 45' ' ' LEU . 51.1 t -80.62 109.38 12.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 123.891 0.876 . . . . 0.0 110.714 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -79.07 -17.86 11.66 Favored 'Trans proline' 0 C--N 1.377 2.037 0 C-N-CA 122.274 1.983 . . . . 0.0 111.476 173.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.441 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 12.7 tp10 -65.52 -52.44 52.59 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 124.644 1.178 . . . . 0.0 110.917 -176.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.528 ' HB3' HG23 ' A' ' 8' ' ' VAL . 75.3 mt -64.9 -29.23 70.16 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.196 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.513 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 31.7 mt -70.63 -55.84 12.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.23 -55.83 21.65 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.474 -170.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.74 79.28 Favored 'General case' 0 N--CA 1.481 1.109 0 O-C-N 124.082 0.863 . . . . 0.0 111.611 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.4 ' HE2' ' HB2' ' A' ' 11' ' ' ARG . 58.0 t80 -63.98 -39.03 93.2 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.463 1.105 . . . . 0.0 111.727 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 89.7 mt -67.76 -38.11 83.01 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.535 0.334 . . . . 0.0 110.281 178.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.04 -28.33 65.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.664 . . . . 0.0 111.195 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m . . . . . 0 N--CA 1.488 1.468 0 C-N-CA 123.243 0.617 . . . . 0.0 111.451 176.737 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 . . . . . 0 N--CA 1.471 0.595 0 N-CA-C 109.891 -0.411 . . . . 0.0 109.891 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 19.2 m -111.02 150.14 29.73 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 121.49 0.662 . . . . 0.0 111.151 -165.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.49 18.39 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 124.934 1.293 . . . . 0.0 109.381 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 N--CA 1.471 0.589 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.38 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 . . . . . 0 N--CA 1.479 1.013 0 N-CA-C 110.0 -0.37 . . . . 0.0 110.0 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.475 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 11.1 m -66.75 134.0 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.019 176.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -101.97 131.65 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.568 0.747 . . . . 0.0 109.351 173.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.37 -56.28 7.05 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.379 0.671 . . . . 0.0 110.585 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.481 ' HA ' HD22 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -159.3 163.07 36.05 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.121 0.486 . . . . 0.0 111.673 -177.234 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 45' ' ' LEU . 72.2 t -82.04 129.19 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.586 171.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.3 mt -86.67 -54.5 4.35 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.199 1.0 . . . . 0.0 110.176 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -151.9 164.51 36.95 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.27 -172.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -131.17 141.22 50.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.392 1.077 . . . . 0.0 109.297 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -136.45 171.05 15.06 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.786 0.834 . . . . 0.0 109.561 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 17' ' ' LYS . 90.4 t -124.1 115.2 44.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 124.205 1.002 . . . . 0.0 108.95 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.421 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 92.4 t -126.31 127.97 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.7 t30 66.08 15.86 10.24 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.2 1.0 . . . . 0.0 111.031 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.54 14.57 75.74 Favored Glycine 0 C--N 1.35 1.33 0 CA-C-N 116.03 -0.532 . . . . 0.0 113.651 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 14.5 ptmt -108.92 157.25 18.8 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.4 t -96.67 125.24 49.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.554 0.741 . . . . 0.0 109.742 177.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 47.1 mt-10 -120.93 135.98 55.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.389 0.676 . . . . 0.0 109.997 174.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.414 ' HE2' ' HB3' ' A' ' 37' ' ' GLU . 96.3 m-85 -109.79 129.47 55.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.447 1.099 . . . . 0.0 109.893 177.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.23 107.95 8.82 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 174.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 5' ' ' VAL . 18.3 mt -102.66 127.44 49.77 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 122.876 0.47 . . . . 0.0 111.347 -172.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? -96.01 121.28 37.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.458 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 66.4 m95 -82.2 137.77 34.84 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.147 0.579 . . . . 0.0 111.27 -173.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.411 ' HB3' HG23 ' A' ' 4' ' ' VAL . 37.7 ttpt -76.6 132.28 39.36 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 123.665 0.786 . . . . 0.0 110.576 -173.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.78 -0.24 89.58 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.689 0.618 . . . . 0.0 113.834 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -104.86 173.36 6.33 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.324 1.05 . . . . 0.0 110.966 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.1 p -65.44 162.05 18.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.791 0.836 . . . . 0.0 112.015 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.81 -41.6 99.36 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.532 0.733 . . . . 0.0 111.248 -176.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.63 -16.59 63.41 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.256 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -81.24 77.73 8.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.139 0.976 . . . . 0.0 109.168 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -143.02 131.51 22.33 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 113.987 -1.461 . . . . 0.0 109.794 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 p -131.74 147.42 52.5 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.957 0.903 . . . . 0.0 110.465 -173.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -76.49 109.53 10.3 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.88 0.472 . . . . 0.0 110.041 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -114.12 129.69 24.59 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.403 1.081 . . . . 0.0 110.458 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 72.7 Cg_endo -72.29 150.81 53.56 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.442 2.095 . . . . 0.0 111.985 175.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.514 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.06 -26.69 64.84 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.319 1.048 . . . . 0.0 113.09 -176.671 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.85 -31.56 72.58 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.658 0.783 . . . . 0.0 111.215 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -91.44 -14.23 30.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.033 0.933 . . . . 0.0 110.555 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.514 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 10.0 mt -79.07 141.01 37.74 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.786 0.434 . . . . 0.0 110.096 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -97.06 0.2 48.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.513 ' HA ' ' HG2' ' B' ' 5' ' ' GLN . 33.5 t -111.02 96.98 32.55 Favored Pre-proline 0 C--N 1.356 0.848 0 C-N-CA 123.661 0.785 . . . . 0.0 111.453 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -78.85 -17.15 12.41 Favored 'Trans proline' 0 C--N 1.375 1.953 0 C-N-CA 122.665 2.243 . . . . 0.0 111.578 169.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -71.13 -43.94 66.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.024 0.929 . . . . 0.0 110.737 -176.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 7' ' ' LYS . 21.2 mt -68.35 -40.18 81.61 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.124 0.569 . . . . 0.0 111.55 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.528 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 66.6 mt -58.62 -52.15 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 123.814 0.696 . . . . 0.0 109.781 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.9 -52.66 64.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.568 0.747 . . . . 0.0 111.298 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.32 71.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.856 0.862 . . . . 0.0 111.598 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.7 -45.3 71.96 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.129 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 79.9 mt -64.85 -35.97 82.85 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 110.403 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.04 -29.09 61.73 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.101 0.96 . . . . 0.0 110.299 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 24.8 t . . . . . 0 CA--C 1.552 1.035 0 C-N-CA 123.43 0.692 . . . . 0.0 110.626 177.306 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.513 ' HG2' ' HA ' ' A' ' 42' ' ' CYS . 4.6 tp-100 . . . . . 0 CA--C 1.545 0.778 0 CA-C-O 121.38 0.61 . . . . 0.0 111.457 . . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 2.0 m -107.02 171.88 7.13 Favored 'General case' 0 CA--C 1.561 1.374 0 C-N-CA 124.021 0.928 . . . . 0.0 110.729 -166.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.8 144.46 17.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.751 0.82 . . . . 0.0 109.423 171.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 . . . . . 0 N--CA 1.479 0.994 0 C-N-CA 122.977 0.511 . . . . 0.0 109.995 177.127 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 . . . . . 0 N--CA 1.473 0.712 0 N-CA-C 110.216 -0.29 . . . . 0.0 110.216 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -80.66 110.81 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.825 0.821 . . . . 0.0 110.388 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.416 HG21 HD22 ' A' ' 22' ' ' LEU . 1.4 p -81.6 131.39 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.733 168.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.505 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 39.1 tt0 -74.94 -49.49 19.97 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 174.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.89 162.42 29.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.318 0.58 . . . . 0.0 111.015 -172.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.488 HG11 ' HD2' ' A' ' 20' ' ' TYR . 61.1 t -89.99 141.27 14.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.363 172.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.3 mt -105.42 -47.6 3.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.96 0.904 . . . . 0.0 109.918 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -144.62 164.47 30.85 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 55.6 ttt180 -138.75 126.5 22.16 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.324 1.05 . . . . 0.0 109.509 -175.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -126.83 164.17 21.98 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.761 0.824 . . . . 0.0 109.856 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.8 t -125.61 116.79 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.2 t -123.62 118.9 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.088 0.955 . . . . 0.0 109.559 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 62.34 32.6 16.88 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.811 1.245 . . . . 0.0 111.784 175.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.2 -26.81 11.8 Favored Glycine 0 N--CA 1.472 1.046 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.301 -177.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -79.44 152.74 30.14 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 123.995 0.918 . . . . 0.0 109.48 -177.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.9 t -114.34 113.69 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.546 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 49.7 mt-10 -106.49 153.47 22.25 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.971 0.908 . . . . 0.0 110.536 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.488 ' HD2' HG11 ' A' ' 8' ' ' VAL . 92.6 m-85 -132.01 126.88 35.02 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.296 1.038 . . . . 0.0 108.95 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -77.55 107.47 10.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.416 HD22 HG21 ' A' ' 5' ' ' VAL . 42.3 mt -96.71 123.34 40.37 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.112 0.565 . . . . 0.0 111.734 -168.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -73.83 106.05 5.38 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 165.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.496 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 76.4 m95 -78.93 116.92 19.55 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 173.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . 38.7 ttpt -61.9 -41.05 97.43 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.756 0.823 . . . . 0.0 112.338 -170.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.62 5.83 79.99 Favored Glycine 0 CA--C 1.534 1.274 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -132.09 170.73 14.56 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.691 0.796 . . . . 0.0 111.407 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 77.5 p -72.83 160.99 31.29 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.533 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.9 -29.56 63.24 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.342 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -22.43 63.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.991 0.516 . . . . 0.0 111.351 174.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -92.29 -1.13 57.28 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.541 0.737 . . . . 0.0 111.164 -178.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.496 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 84.4 m-20 -64.89 139.49 58.77 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.978 0.511 . . . . 0.0 110.666 173.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 39.5 p -131.57 155.77 46.92 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.185 0.594 . . . . 0.0 112.116 -170.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -77.3 113.48 15.12 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.532 0.733 . . . . 0.0 109.444 171.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -121.9 129.56 25.1 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 122.913 0.485 . . . . 0.0 110.379 176.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.546 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 73.4 Cg_endo -71.75 149.89 55.23 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 122.737 2.291 . . . . 0.0 112.18 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.445 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 9.5 pt-20 -60.28 -24.0 64.58 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.867 0.867 . . . . 0.0 112.741 -175.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.51 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 9.3 pt-20 -65.81 -35.36 80.48 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.902 0.881 . . . . 0.0 111.307 175.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -82.42 -21.94 35.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.386 1.074 . . . . 0.0 110.687 -175.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.532 HD22 ' HB1' ' B' ' 7' ' ' ALA . 7.6 mt -86.14 142.14 28.87 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -108.75 26.13 10.93 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 173.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 47.0 t -117.28 90.85 35.4 Favored Pre-proline 0 C--N 1.346 0.451 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.902 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -70.96 -22.16 26.93 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 122.507 2.138 . . . . 0.0 111.013 170.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.86 -60.18 3.95 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 124.118 0.967 . . . . 0.0 111.445 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.44 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 89.6 mt -78.22 -29.73 48.45 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.802 0.441 . . . . 0.0 112.027 -172.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 93.0 mt -63.68 -56.08 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -41.56 69.66 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.594 -174.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -34.23 77.68 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.046 0.216 . . . . 0.0 111.148 -177.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -60.42 -44.21 95.98 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.606 0.762 . . . . 0.0 110.799 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 69.4 mt -66.92 -39.02 87.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.781 178.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -71.61 -21.77 61.8 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.904 0.882 . . . . 0.0 111.42 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.1 m . . . . . 0 N--CA 1.477 0.911 0 C-N-CA 123.064 0.545 . . . . 0.0 110.226 173.702 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.479 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 20.5 tp60 . . . . . 0 CA--C 1.545 0.756 0 CA-C-O 120.948 0.404 . . . . 0.0 110.029 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -86.75 173.98 9.12 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 124.106 0.963 . . . . 0.0 113.075 -160.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . 0.532 ' HB1' HD22 ' A' ' 40' ' ' LEU . . . -147.78 155.06 41.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 . . . . . 0 CA--C 1.548 0.896 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.158 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.453 ' HE2' ' H ' ' A' ' 26' ' ' GLY . 47.1 t80 . . . . . 0 N--CA 1.474 0.726 0 N-CA-C 109.635 -0.506 . . . . 0.0 109.635 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 65.5 t -77.68 116.87 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.086 0.555 . . . . 0.0 110.926 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.455 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.2 p -92.55 142.0 13.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 123.863 0.865 . . . . 0.0 110.66 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -79.64 -57.85 3.47 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.173 0.989 . . . . 0.0 110.848 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -160.81 169.39 22.8 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.794 0.438 . . . . 0.0 111.866 -175.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.441 HG13 ' HB3' ' A' ' 20' ' ' TYR . 43.9 t -92.17 141.45 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.061 0.944 . . . . 0.0 109.194 171.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.1 mt -111.43 -35.4 5.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.508 1.123 . . . . 0.0 110.786 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -157.26 164.62 37.49 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.434 0.694 . . . . 0.0 109.812 -173.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -132.7 154.02 50.56 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.985 0.914 . . . . 0.0 109.971 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.24 161.47 40.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.956 0.902 . . . . 0.0 109.28 174.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t -116.87 124.19 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 169.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.425 HG12 HD22 ' A' ' 15' ' ' ASN . 47.0 t -112.49 108.83 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 176.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . 0.425 HD22 HG12 ' A' ' 14' ' ' VAL . 36.6 m-80 64.97 -73.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.153 1.381 . . . . 0.0 111.033 -172.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -147.72 -9.34 0.2 Allowed Glycine 0 CA--C 1.528 0.852 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.607 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' A' ' 36' ' ' PRO . 15.6 ptmt -81.28 170.47 16.02 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 99.1 t -124.51 127.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.139 0.576 . . . . 0.0 109.497 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -118.33 139.52 51.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.441 ' HB3' HG13 ' A' ' 8' ' ' VAL . 98.0 m-85 -111.28 132.66 54.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.293 1.037 . . . . 0.0 109.641 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -78.42 108.56 11.86 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.8 mt -101.41 123.04 44.84 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.34 0.656 . . . . 0.0 112.169 -168.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -78.07 110.13 12.76 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 165.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.559 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 71.9 m95 -80.7 148.95 29.94 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 122.862 0.465 . . . . 0.0 110.342 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.2 ttpt -58.52 -48.44 80.84 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 123.67 0.606 . . . . 0.0 110.94 178.835 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . 0.453 ' H ' ' HE2' ' A' ' 3' ' ' PHE . . . -103.76 15.3 52.61 Favored Glycine 0 C--N 1.34 0.805 0 CA-C-N 115.584 -0.735 . . . . 0.0 114.207 -173.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.559 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 55.5 m-85 -132.83 136.64 46.38 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 117.605 0.702 . . . . 0.0 109.925 175.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.5 p -80.71 -179.22 7.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.292 1.037 . . . . 0.0 111.835 -175.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -49.83 -51.45 39.83 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.135 1.374 . . . . 0.0 113.582 -170.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.12 -20.84 62.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 27' ' ' PHE . 11.1 t70 -91.25 -17.85 25.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.833 0.453 . . . . 0.0 111.209 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -58.17 136.99 57.36 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.479 0.712 . . . . 0.0 111.672 -177.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 33.8 p -128.41 156.79 42.6 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.372 0.669 . . . . 0.0 112.669 -166.758 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -80.32 117.53 21.16 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.095 0.958 . . . . 0.0 110.369 173.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -118.66 135.52 23.72 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 123.006 0.523 . . . . 0.0 110.311 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.509 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . 94.9 Cg_endo -74.55 150.94 41.29 Favored 'Trans proline' 0 C--N 1.365 1.425 0 C-N-CA 122.463 2.109 . . . . 0.0 112.511 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -27.69 64.46 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.032 0.933 . . . . 0.0 112.572 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 15.7 pt-20 -60.7 -35.75 77.08 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.199 0.6 . . . . 0.0 110.94 177.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -83.51 -34.78 25.24 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.788 0.835 . . . . 0.0 111.149 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.528 HD12 HD11 ' A' ' 46' ' ' ILE . 19.2 mt -62.78 136.75 58.03 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -170.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -108.57 29.52 7.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 171.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.473 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 19.7 m -116.27 89.51 26.39 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.262 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.97 -26.48 6.58 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.742 1.628 . . . . 0.0 111.097 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.51 -56.14 13.99 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 124.328 1.051 . . . . 0.0 111.127 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.541 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 83.9 mt -65.95 -40.26 91.17 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.677 0.61 . . . . 0.0 111.638 -174.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.528 HD11 HD12 ' A' ' 40' ' ' LEU . 76.5 mt -66.36 -47.94 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.472 0.483 . . . . 0.0 110.54 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.34 -50.85 72.16 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.317 0.647 . . . . 0.0 110.794 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -37.25 85.92 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.534 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -64.2 -49.75 70.79 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.132 0.973 . . . . 0.0 110.805 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 80.0 mt -66.24 -38.61 88.3 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.904 -177.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -78.16 -18.32 55.71 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.8 t . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 120.898 0.38 . . . . 0.0 110.016 174.162 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.541 ' HG3' ' HG ' ' A' ' 45' ' ' LEU . 87.4 mm-40 . . . . . 0 N--CA 1.469 0.486 0 CA-C-O 120.742 0.306 . . . . 0.0 110.556 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 37.4 m -110.63 137.35 48.43 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.534 0.733 . . . . 0.0 109.24 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -129.1 145.47 51.28 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.866 0.866 . . . . 0.0 108.988 176.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 67.2 mtt85 . . . . . 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.852 -172.585 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 . . . . . 0 N--CA 1.469 0.488 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.513 HG22 HG22 ' B' ' 6' ' ' THR . 47.0 t -84.35 132.08 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 176.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.498 HG21 HD22 ' A' ' 22' ' ' LEU . 1.2 p -100.88 121.8 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 109.325 -0.621 . . . . 0.0 109.325 172.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 14.8 tp10 -53.59 -57.22 11.52 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.554 1.142 . . . . 0.0 110.821 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -164.21 162.03 22.42 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 -174.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.494 HG13 ' HB3' ' A' ' 20' ' ' TYR . 85.9 t -85.28 116.71 29.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.1 mt -82.9 -35.69 25.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.013 0.525 . . . . 0.0 111.888 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -164.56 162.73 21.84 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.259 0.349 . . . . 0.0 110.995 -171.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.484 ' NH2' HD21 ' A' ' 50' ' ' LEU . 31.3 ttm180 -118.59 149.26 41.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.309 1.044 . . . . 0.0 109.539 173.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -132.2 160.78 35.12 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 165.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 85.9 t -120.95 108.46 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 167.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.61 128.56 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 66.02 22.2 11.23 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.843 1.257 . . . . 0.0 111.772 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.45 6.08 89.05 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.781 -0.645 . . . . 0.0 113.357 -176.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -104.26 143.13 33.37 Favored 'General case' 0 C--N 1.348 0.523 0 C-N-CA 124.285 1.034 . . . . 0.0 109.702 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -91.08 119.45 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.402 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.53 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 43.0 mt-10 -128.19 162.71 26.34 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.144 0.978 . . . . 0.0 109.576 -178.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.494 ' HB3' HG13 ' A' ' 8' ' ' VAL . 87.7 m-85 -140.68 134.45 30.39 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.528 0.731 . . . . 0.0 110.147 -172.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -78.51 106.94 10.81 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 174.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.688 HD11 HD22 ' A' ' 40' ' ' LEU . 28.4 mt -87.98 123.35 32.6 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.351 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -78.11 99.45 6.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.551 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 63.0 m95 -63.88 126.26 27.05 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 171.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.571 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 38.0 ttpt -51.21 -54.44 25.59 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.411 1.484 . . . . 0.0 113.516 -164.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.75 30.69 9.78 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 116.78 -0.191 . . . . 0.0 112.855 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.551 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.6 m-85 -135.55 142.21 45.33 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.375 0.67 . . . . 0.0 110.234 -178.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.8 p -64.75 159.24 22.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.251 1.02 . . . . 0.0 112.141 -175.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.23 -34.81 78.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.298 0.639 . . . . 0.0 112.064 -177.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.82 -19.3 64.27 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.424 0.69 . . . . 0.0 111.546 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -99.82 -18.4 17.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.452 1.101 . . . . 0.0 110.844 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.482 ' HB3' ' O ' ' A' ' 22' ' ' LEU . 11.8 m120 -68.11 146.61 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.195 0.598 . . . . 0.0 111.183 175.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 42.7 p -126.07 165.06 19.54 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.32 0.648 . . . . 0.0 112.358 -166.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -88.4 116.9 26.95 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.993 0.917 . . . . 0.0 109.847 173.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -121.8 133.62 24.35 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 123.688 0.795 . . . . 0.0 110.744 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.53 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 58.2 Cg_endo -69.26 156.07 65.72 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.591 2.194 . . . . 0.0 111.667 176.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.419 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -51.49 -30.16 19.08 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.367 1.067 . . . . 0.0 113.43 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.42 -37.91 80.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.336 0.654 . . . . 0.0 110.983 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -89.83 3.26 53.49 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.491 0.717 . . . . 0.0 111.1 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.688 HD22 HD11 ' A' ' 22' ' ' LEU . 10.8 mt -88.66 124.25 33.9 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.451 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 32.5 t70 -84.1 -33.57 24.32 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 175.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.564 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 17.6 p -71.57 109.44 5.52 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 124.403 1.081 . . . . 0.0 110.839 174.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.451 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 73.4 Cg_endo -87.12 -19.39 2.52 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.253 1.968 . . . . 0.0 111.953 170.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.57 -35.58 60.57 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.932 0.893 . . . . 0.0 110.789 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.2 mt -69.98 -32.63 70.94 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.614 0.366 . . . . 0.0 110.865 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 29.3 mt -68.49 -46.56 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . 0.402 ' HG2' ' ND2' ' A' ' 51' ' ' ASN . 37.1 tt0 -62.13 -45.23 94.36 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.51 178.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.74 -32.14 73.25 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.173 0.589 . . . . 0.0 111.627 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.45 -40.19 96.48 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.85 0.86 . . . . 0.0 110.501 173.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.484 HD21 ' NH2' ' A' ' 11' ' ' ARG . 91.4 mt -73.22 -34.79 66.11 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.363 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . 0.402 ' ND2' ' HG2' ' A' ' 47' ' ' GLU . 91.0 m-20 -76.7 -14.97 59.91 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.835 0.854 . . . . 0.0 111.084 179.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.3 t . . . . . 0 N--CA 1.472 0.633 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.868 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.564 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 46.1 tt0 . . . . . 0 CA--C 1.553 1.079 0 CA-C-O 122.227 1.013 . . . . 0.0 108.563 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.513 HG22 HG22 ' A' ' 4' ' ' VAL . 21.8 p -96.27 179.42 5.05 Favored 'General case' 0 C--O 1.246 0.92 0 C-N-CA 124.284 1.033 . . . . 0.0 111.55 -176.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -176.97 179.97 0.98 Allowed 'General case' 0 C--O 1.246 0.912 0 C-N-CA 125.336 1.454 . . . . 0.0 108.71 177.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.1 ttp85 . . . . . 0 N--CA 1.471 0.601 0 C-N-CA 123.805 0.842 . . . . 0.0 108.839 -179.561 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 110.14 -0.318 . . . . 0.0 110.14 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.65 122.5 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.551 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -97.26 134.9 33.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 123.657 0.783 . . . . 0.0 109.427 175.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.0 -55.98 9.18 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.003 0.921 . . . . 0.0 109.752 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -162.92 166.75 23.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.443 0.697 . . . . 0.0 110.875 -174.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.414 HG11 ' HD2' ' A' ' 20' ' ' TYR . 60.0 t -90.41 142.34 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 169.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.7 mt -106.77 -45.58 4.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.707 0.803 . . . . 0.0 111.058 -178.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -149.6 161.85 41.35 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.811 0.339 . . . . 0.0 110.933 -175.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -122.42 151.87 40.8 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.092 1.357 . . . . 0.0 108.605 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -153.23 163.58 39.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.123 0.569 . . . . 0.0 110.272 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.2 t -117.59 115.11 47.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 123.961 0.904 . . . . 0.0 109.178 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.413 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 88.6 t -116.45 109.85 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.362 1.065 . . . . 0.0 109.47 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.8 m120 60.93 17.92 8.32 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 124.303 1.041 . . . . 0.0 112.851 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.91 -24.38 14.93 Favored Glycine 0 C--N 1.347 1.159 0 CA-C-O 119.829 -0.428 . . . . 0.0 113.367 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptmt -81.92 170.98 14.99 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.951 0.5 . . . . 0.0 109.823 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -120.54 118.57 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.229 0.612 . . . . 0.0 110.214 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.571 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 61.6 mt-10 -111.02 152.23 27.09 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.809 0.844 . . . . 0.0 110.687 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.434 ' HE1' ' HB3' ' A' ' 37' ' ' GLU . 94.0 m-85 -130.09 126.9 38.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.651 1.18 . . . . 0.0 109.268 -176.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -78.32 108.35 11.6 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.481 HD11 HD22 ' A' ' 40' ' ' LEU . 39.9 mt -90.29 122.39 33.15 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 -174.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.37 96.79 6.11 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 163.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.5 m95 -67.88 135.27 52.23 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.364 0.415 . . . . 0.0 110.241 179.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -69.92 131.25 44.13 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.9 -35.27 3.82 Favored Glycine 0 C--N 1.347 1.145 0 O-C-N 123.314 0.384 . . . . 0.0 112.903 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.56 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 64.6 m-85 -91.65 144.74 25.21 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.636 0.775 . . . . 0.0 109.875 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.1 p -73.77 163.37 28.05 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.861 0.864 . . . . 0.0 112.1 -174.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.429 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.9 p-10 -59.55 -33.76 71.82 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.846 0.858 . . . . 0.0 111.389 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.03 -28.1 60.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.846 0.858 . . . . 0.0 111.839 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -88.51 -11.87 44.53 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.491 0.716 . . . . 0.0 111.25 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.552 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.8 m120 -63.25 157.66 22.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.1 p -143.65 154.67 43.76 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.488 0.715 . . . . 0.0 111.403 -172.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -77.54 124.02 27.37 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.899 0.88 . . . . 0.0 109.139 171.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -124.68 129.63 24.55 Favored Pre-proline 0 N--CA 1.468 0.458 0 C-N-CA 123.15 0.58 . . . . 0.0 110.761 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.571 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 51.4 Cg_endo -66.7 159.82 49.35 Favored 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.685 2.257 . . . . 0.0 111.91 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.434 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -64.69 -24.77 67.68 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.551 0.74 . . . . 0.0 112.786 -176.277 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.02 -31.45 72.64 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.961 0.904 . . . . 0.0 110.624 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.03 -12.86 32.02 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.525 1.13 . . . . 0.0 111.216 -172.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.481 HD22 HD11 ' A' ' 22' ' ' LEU . 21.5 mt -86.53 120.97 28.43 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.502 0.721 . . . . 0.0 110.346 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . 0.487 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 26.9 t70 -83.08 -30.1 28.26 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 173.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.1 p -78.23 106.29 3.87 Favored Pre-proline 0 CA--C 1.559 1.319 0 C-N-CA 124.8 1.24 . . . . 0.0 112.164 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.487 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 64.8 Cg_endo -87.96 -18.51 2.31 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.736 2.291 . . . . 0.0 113.064 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . 0.429 ' HB3' ' OE1' ' B' ' 5' ' ' GLN . 35.2 tt0 -75.25 -36.22 61.3 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.722 0.809 . . . . 0.0 110.441 -174.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -67.22 -39.7 86.3 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.113 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 62.7 mt -63.39 -47.55 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 176.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.97 -53.27 60.25 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.264 1.026 . . . . 0.0 111.296 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.92 -33.63 74.6 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.609 0.764 . . . . 0.0 111.109 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -71.34 -36.87 71.69 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.169 0.988 . . . . 0.0 111.421 176.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 96.8 mt -67.83 -36.72 80.85 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 176.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -67.27 -28.41 68.01 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.256 1.022 . . . . 0.0 110.529 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.9 m . . . . . 0 N--CA 1.481 1.101 0 C-N-CA 123.198 0.599 . . . . 0.0 110.557 175.58 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.429 ' OE1' ' HB3' ' A' ' 44' ' ' GLU . 33.3 mm-40 . . . . . 0 N--CA 1.468 0.444 0 CA-C-O 120.79 0.329 . . . . 0.0 111.053 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 8.8 t -127.22 159.87 32.99 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 123.81 0.844 . . . . 0.0 110.43 -173.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -156.55 163.83 38.92 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.987 1.315 . . . . 0.0 108.094 173.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.469 ' HD2' ' N ' ' B' ' 8' ' ' ARG . 1.8 mpt_? . . . . . 0 N--CA 1.473 0.679 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.465 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 . . . . . 0 N--CA 1.479 0.995 0 N-CA-C 109.921 -0.4 . . . . 0.0 109.921 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 18.9 t -78.44 134.0 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 122.75 0.42 . . . . 0.0 110.613 -174.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.45 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -112.92 135.82 51.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.865 1.266 . . . . 0.0 110.285 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.689 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 18.1 tp10 -70.05 -54.82 11.42 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.924 1.29 . . . . 0.0 110.962 175.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.689 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.19 169.08 5.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.034 0.934 . . . . 0.0 111.104 170.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.5 t -77.16 141.26 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.966 172.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.1 mt -109.34 -41.15 4.71 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.645 0.778 . . . . 0.0 111.179 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -147.12 164.28 33.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.886 0.474 . . . . 0.0 110.322 -169.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -132.89 151.63 52.0 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.423 1.089 . . . . 0.0 110.137 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -148.68 163.89 35.96 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.219 1.007 . . . . 0.0 109.522 174.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.0 t -115.99 108.37 24.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 170.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.1 t -91.34 110.2 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.5 m120 66.68 -73.3 0.08 Allowed 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.955 1.302 . . . . 0.0 111.201 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -160.26 34.66 0.43 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 175.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.4 ptmt -130.82 151.54 51.14 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.469 0.708 . . . . 0.0 109.601 177.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 95.3 t -90.54 130.15 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 122.634 0.374 . . . . 0.0 110.19 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 25.9 mt-10 -124.97 149.05 48.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 109.739 170.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.504 ' HB2' HD11 ' A' ' 40' ' ' LEU . 92.4 m-85 -122.93 132.59 54.23 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.22 1.008 . . . . 0.0 110.026 -178.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -78.12 109.38 12.16 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.194 0.997 . . . . 0.0 108.778 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.514 HD11 HD22 ' A' ' 40' ' ' LEU . 20.6 mt -88.81 126.07 35.19 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.06 0.544 . . . . 0.0 111.139 -176.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -80.0 107.43 12.78 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 162.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.529 ' CD1' ' HA ' ' A' ' 32' ' ' ASN . 90.3 m95 -72.33 134.38 45.46 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.591 0.356 . . . . 0.0 110.795 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -69.83 -60.78 2.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.844 0.858 . . . . 0.0 111.158 -173.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.76 32.84 6.38 Favored Glycine 0 C--N 1.344 0.976 0 CA-C-N 115.774 -0.648 . . . . 0.0 113.321 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.41 ' HD2' ' HB3' ' A' ' 24' ' ' TRP . 85.4 m-85 -137.27 163.91 29.8 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.124 0.969 . . . . 0.0 108.689 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.7 t -72.57 164.96 25.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.096 0.558 . . . . 0.0 111.619 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -73.12 -42.95 62.36 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.662 0.785 . . . . 0.0 112.692 -165.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.53 -13.66 60.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.986 0.515 . . . . 0.0 111.858 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -79.35 -10.89 59.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.218 1.007 . . . . 0.0 111.994 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.529 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 9.9 m120 -64.99 136.13 56.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.117 0.567 . . . . 0.0 112.319 -174.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.3 p -138.4 162.29 34.79 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.249 0.62 . . . . 0.0 112.341 -165.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -79.0 123.11 26.98 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.515 1.126 . . . . 0.0 111.123 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.42 ' HB2' HD21 ' A' ' 40' ' ' LEU . 57.2 mm-40 -121.65 135.1 24.88 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 171.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 38.5 Cg_endo -65.35 155.87 66.33 Favored 'Trans proline' 0 C--N 1.372 1.764 0 C-N-CA 122.329 2.019 . . . . 0.0 111.333 175.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.401 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.01 -26.24 62.13 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.74 0.816 . . . . 0.0 112.502 -178.923 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.424 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 10.4 pt-20 -71.64 -27.94 63.43 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.451 0.701 . . . . 0.0 110.841 178.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.484 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.7 m-20 -88.7 -16.37 32.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.924 0.89 . . . . 0.0 111.43 177.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.514 HD22 HD11 ' A' ' 22' ' ' LEU . 23.6 mt -77.28 124.9 28.48 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.723 0.409 . . . . 0.0 110.362 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.97 24.0 12.82 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 p -121.29 89.11 46.45 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 123.652 0.781 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . 0.434 ' HD2' HE22 ' B' ' 5' ' ' GLN . 29.0 Cg_exo -65.35 -48.17 3.64 Favored 'Trans proline' 0 C--N 1.376 1.982 0 C-N-CA 123.063 2.509 . . . . 0.0 113.736 -177.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -64.42 -29.57 70.62 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.696 0.799 . . . . 0.0 112.165 -173.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 7' ' ' LYS . 53.1 mt -78.04 -35.84 49.24 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.399 0.68 . . . . 0.0 111.426 -176.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 71.6 mt -65.2 -47.51 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.41 -46.02 80.39 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.191 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.13 84.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.028 0.931 . . . . 0.0 110.923 -176.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -68.16 -46.35 71.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.918 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.23 -24.25 63.06 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.321 0.649 . . . . 0.0 110.178 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -74.78 -25.75 59.28 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.622 1.169 . . . . 0.0 109.853 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.2 m . . . . . 0 CA--C 1.548 0.9 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.52 172.924 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.434 HE22 ' HD2' ' A' ' 43' ' ' PRO . 16.0 mm-40 . . . . . 0 CA--C 1.532 0.272 0 CA-C-O 120.961 0.41 . . . . 0.0 110.205 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 10.1 t -131.94 179.12 6.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.349 -165.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.89 -179.61 8.22 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.84 0.856 . . . . 0.0 110.635 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.484 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 76.6 ttt180 . . . . . 0 N--CA 1.471 0.624 0 C-N-CA 125.082 1.353 . . . . 0.0 107.698 -173.072 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 . . . . . 0 N--CA 1.492 1.629 0 N-CA-C 110.311 -0.255 . . . . 0.0 110.311 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 30.6 m -73.45 134.86 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.567 0.747 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.434 HG21 HD22 ' A' ' 22' ' ' LEU . 1.7 p -125.79 133.5 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.511 0.724 . . . . 0.0 110.014 174.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.822 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 10.6 tp10 -56.11 -64.84 0.73 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.364 1.466 . . . . 0.0 110.58 172.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.822 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.83 170.12 4.68 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.313 1.045 . . . . 0.0 110.689 169.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 49' ' ' PHE . 63.4 t -66.07 139.55 21.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.07 172.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 23' ' ' LYS . 86.3 mt -111.63 -30.14 7.46 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 123.78 0.832 . . . . 0.0 110.865 -177.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -159.43 163.39 35.46 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.638 0.375 . . . . 0.0 110.702 -172.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -136.33 147.69 47.53 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.103 0.961 . . . . 0.0 110.397 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -151.09 172.72 15.32 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.473 1.109 . . . . 0.0 108.821 174.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -129.98 118.54 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.518 0.727 . . . . 0.0 109.273 174.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.1 t -125.98 123.82 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.078 0.951 . . . . 0.0 109.335 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.9 m120 62.99 26.72 15.64 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.763 1.225 . . . . 0.0 111.969 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.76 -23.5 30.48 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.269 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -77.66 148.95 34.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.711 1.205 . . . . 0.0 109.458 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.9 t -106.12 116.06 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.629 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -104.41 154.62 19.63 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 110.261 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.433 ' HD1' HG11 ' A' ' 8' ' ' VAL . 91.1 m-85 -138.48 124.27 19.86 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.484 1.114 . . . . 0.0 109.519 -175.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -78.5 109.3 12.55 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.434 HD22 HG21 ' A' ' 5' ' ' VAL . 54.2 mt -96.36 127.66 42.56 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.613 0.765 . . . . 0.0 111.209 -172.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 6' ' ' GLU . 3.4 tmtp? -80.11 96.87 6.63 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 167.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.577 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 92.5 m95 -63.95 117.58 7.22 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 13.1 ttpp -66.11 -34.19 77.5 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 124.22 0.95 . . . . 0.0 111.829 -168.571 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.73 16.95 60.13 Favored Glycine 0 C--N 1.343 0.965 0 CA-C-N 115.977 -0.556 . . . . 0.0 113.604 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.439 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 98.7 m-85 -139.01 157.57 45.76 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.662 0.785 . . . . 0.0 110.058 -177.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 t -69.09 162.54 26.73 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.274 0.63 . . . . 0.0 111.865 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.68 -34.42 78.17 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.854 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.87 -22.34 60.79 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.088 0.555 . . . . 0.0 111.663 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -88.72 -3.78 58.69 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.833 0.853 . . . . 0.0 110.883 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.577 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.7 m120 -70.03 138.35 52.07 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.06 0.544 . . . . 0.0 111.079 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.0 p -130.36 165.26 22.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.37 0.668 . . . . 0.0 111.821 -170.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -83.95 116.41 22.78 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.059 0.944 . . . . 0.0 110.146 173.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -117.14 131.56 23.94 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 123.074 0.549 . . . . 0.0 110.116 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.629 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.5 Cg_endo -66.5 165.3 25.56 Favored 'Trans proline' 0 C--N 1.367 1.542 0 C-N-CA 122.392 2.061 . . . . 0.0 113.001 175.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.41 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.22 -29.14 67.3 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.255 1.022 . . . . 0.0 112.546 -178.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.35 -34.03 76.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.749 0.819 . . . . 0.0 110.984 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -77.11 -33.64 56.86 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.568 0.747 . . . . 0.0 111.156 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.41 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 34.9 mt -62.08 124.98 22.3 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.517 0.327 . . . . 0.0 111.259 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -108.23 19.54 19.77 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 122.653 1.216 . . . . 0.0 108.151 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.431 ' O ' HG13 ' A' ' 46' ' ' ILE . 12.9 p -127.69 87.52 55.75 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.398 -176.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.87 -27.32 26.11 Favored 'Trans proline' 0 C--N 1.377 2.058 0 C-N-CA 122.491 2.127 . . . . 0.0 111.786 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.15 -38.64 82.36 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.696 0.798 . . . . 0.0 111.187 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.554 HD13 ' HA ' ' A' ' 7' ' ' LYS . 77.6 mt -78.73 -23.59 45.37 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.259 0.624 . . . . 0.0 111.312 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 42' ' ' CYS . 79.9 mt -67.3 -52.39 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 169.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.16 -44.8 79.63 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.401 1.081 . . . . 0.0 110.994 177.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.52 -43.98 97.89 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.64 -177.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.468 ' HB2' ' HB ' ' A' ' 8' ' ' VAL . 43.4 t80 -59.43 -47.86 83.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 124.282 0.988 . . . . 0.0 111.102 177.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 86.1 mt -60.42 -38.59 84.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.442 0.697 . . . . 0.0 110.548 179.342 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.91 -24.63 59.72 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.616 0.766 . . . . 0.0 111.284 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 52.5 m . . . . . 0 N--CA 1.479 0.993 0 C-N-CA 123.266 0.626 . . . . 0.0 111.388 178.827 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 . . . . . 0 CA--C 1.54 0.593 0 N-CA-C 109.007 -0.738 . . . . 0.0 109.007 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 42.8 p -93.2 170.89 9.29 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 122.492 1.139 . . . . 0.0 113.808 -164.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.27 -179.82 7.67 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-N 113.737 -1.574 . . . . 0.0 108.692 172.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 31.7 ttm180 . . . . . 0 N--CA 1.467 0.422 0 C-N-CA 123.601 0.761 . . . . 0.0 109.716 -175.798 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 . . . . . 0 CA--C 1.54 0.585 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.2 t -75.83 130.55 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.494 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -106.57 119.61 56.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.292 0.637 . . . . 0.0 109.927 174.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.425 ' HG3' ' HG2' ' A' ' 7' ' ' LYS . 11.7 tp10 -48.35 -57.17 6.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.747 1.619 . . . . 0.0 110.989 172.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HG2' ' HG3' ' A' ' 6' ' ' GLU . 3.6 ptpp? -170.36 156.94 5.87 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.72 0.808 . . . . 0.0 110.929 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.427 HG23 ' HB3' ' A' ' 45' ' ' LEU . 85.3 t -71.85 120.27 19.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.869 169.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -87.75 -49.42 7.14 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.265 0.626 . . . . 0.0 110.841 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -147.8 164.88 32.25 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 -170.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -137.54 134.73 36.01 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.286 1.034 . . . . 0.0 109.605 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -138.52 175.75 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.325 0.65 . . . . 0.0 109.907 177.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -123.18 123.67 68.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 108.452 174.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 75.9 t -133.64 122.05 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.766 0.826 . . . . 0.0 109.175 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 66.54 19.67 10.85 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.928 1.291 . . . . 0.0 111.694 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.8 -19.74 53.11 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.923 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -81.66 166.28 20.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.831 0.453 . . . . 0.0 109.85 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.8 t -114.42 110.55 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 123.774 0.83 . . . . 0.0 108.911 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 95.7 mt-10 -104.53 156.1 18.24 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.62 0.768 . . . . 0.0 110.475 -177.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.417 ' HD2' HG11 ' A' ' 8' ' ' VAL . 48.0 m-85 -134.9 124.06 24.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.391 1.077 . . . . 0.0 108.444 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -76.72 107.68 9.2 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.577 HD11 HD22 ' A' ' 40' ' ' LEU . 43.0 mt -92.65 123.69 36.12 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.344 -174.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -77.38 98.97 5.42 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.634 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 82.9 m95 -67.54 122.01 17.08 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 173.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -66.7 -26.99 67.28 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 123.643 0.589 . . . . 0.0 111.905 -175.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.28 -7.8 82.35 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-N 116.379 -0.373 . . . . 0.0 113.661 179.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -129.44 162.84 27.16 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.593 0.757 . . . . 0.0 110.784 -174.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.8 p -73.14 161.63 30.38 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.387 0.675 . . . . 0.0 110.861 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.483 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 21.0 m-20 -57.8 -36.39 72.14 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.576 0.547 . . . . 0.0 110.999 177.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.88 -18.0 60.5 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.034 0.934 . . . . 0.0 112.542 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -99.12 -8.1 25.69 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.408 0.283 . . . . 0.0 111.365 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.634 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.9 m120 -65.74 158.55 27.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.452 0.701 . . . . 0.0 112.584 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.0 p -140.76 158.76 43.49 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 121.403 0.621 . . . . 0.0 112.304 -173.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -80.67 123.24 28.0 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.862 1.265 . . . . 0.0 109.828 173.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -123.3 133.41 24.52 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 122.849 0.46 . . . . 0.0 110.142 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 56.0 Cg_endo -66.98 156.97 63.92 Favored 'Trans proline' 0 C--N 1.371 1.747 0 C-N-CA 122.911 2.407 . . . . 0.0 112.12 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.401 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -56.52 -31.32 63.99 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.852 0.861 . . . . 0.0 113.1 -176.779 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.66 -28.21 68.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.258 1.023 . . . . 0.0 111.736 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.441 ' OD1' ' HB3' ' B' ' 8' ' ' ARG . 57.0 t30 -89.47 -15.23 33.56 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.463 1.105 . . . . 0.0 111.082 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.577 HD22 HD11 ' A' ' 22' ' ' LEU . 28.5 mt -79.04 130.3 35.37 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.099 0.56 . . . . 0.0 110.961 -173.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -105.6 12.53 31.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.891 0.877 . . . . 0.0 109.763 175.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.5 p -113.16 90.3 16.07 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.234 1.014 . . . . 0.0 109.166 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.51 -29.53 1.81 Allowed 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.607 2.205 . . . . 0.0 112.958 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.92 -29.34 61.99 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.481 0.712 . . . . 0.0 111.122 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.427 ' HB3' HG23 ' A' ' 8' ' ' VAL . 32.6 mt -68.37 -30.09 68.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.528 0.331 . . . . 0.0 111.605 175.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.409 HD11 ' CD1' ' A' ' 40' ' ' LEU . 47.8 mm -71.71 -47.83 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.362 0.414 . . . . 0.0 110.343 176.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -54.96 -50.2 69.5 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.819 0.699 . . . . 0.0 110.386 174.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.36 -50.71 72.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.763 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 73.3 t80 -55.85 -50.86 69.43 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.254 1.022 . . . . 0.0 111.756 -178.425 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 95.9 mt -64.43 -47.5 78.89 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.606 0.762 . . . . 0.0 111.128 -176.802 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -66.16 -23.17 66.42 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.577 0.751 . . . . 0.0 111.524 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.3 m . . . . . 0 N--CA 1.477 0.877 0 C-N-CA 123.374 0.67 . . . . 0.0 112.482 -178.922 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 . . . . . 0 CA--C 1.543 0.682 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 21.8 p -134.51 169.83 16.68 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.75 0.82 . . . . 0.0 110.738 -170.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -168.26 165.39 13.04 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.864 0.866 . . . . 0.0 109.583 173.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.441 ' HB3' ' OD1' ' A' ' 39' ' ' ASN . 38.4 ttm-85 . . . . . 0 CA--C 1.544 0.726 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 174.37 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . 0.44 ' HD2' ' HA ' ' B' ' 8' ' ' ARG . 67.4 m-85 . . . . . 0 C--O 1.244 0.775 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.29 115.54 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.04 -177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.559 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.1 p -98.57 130.66 47.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 124.212 1.005 . . . . 0.0 109.292 171.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.83 -62.38 1.9 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.628 0.771 . . . . 0.0 109.912 173.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -165.71 168.88 15.75 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.458 0.646 . . . . 0.0 110.943 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.405 HG13 ' HB3' ' A' ' 20' ' ' TYR . 77.8 t -74.1 136.23 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.056 170.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.9 mt -103.0 -36.18 8.28 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.41 0.684 . . . . 0.0 110.201 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -156.12 162.74 40.2 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.27 -173.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -124.13 143.94 50.19 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.573 1.149 . . . . 0.0 109.344 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -137.78 164.76 28.11 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.728 0.811 . . . . 0.0 109.588 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.486 HG22 HG22 ' A' ' 18' ' ' VAL . 59.2 t -123.8 106.13 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 169.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.3 t -85.62 102.92 11.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 172.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 68.22 -76.08 0.06 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.257 1.423 . . . . 0.0 110.813 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.51 -10.29 0.82 Allowed Glycine 0 N--CA 1.477 1.409 0 C-N-CA 123.401 0.524 . . . . 0.0 112.833 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.566 ' HD2' ' HB3' ' A' ' 36' ' ' PRO . 18.7 ttpt -95.83 146.08 24.84 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.978 1.311 . . . . 0.0 109.319 -179.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.486 HG22 HG22 ' A' ' 13' ' ' VAL . 85.9 t -98.5 129.35 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.843 0.857 . . . . 0.0 109.822 177.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 33.9 mt-10 -121.07 148.05 44.69 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.405 ' HB3' HG13 ' A' ' 8' ' ' VAL . 88.5 m-85 -116.96 135.82 53.41 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.138 0.975 . . . . 0.0 109.551 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -78.64 106.78 10.86 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.525 HD11 HD22 ' A' ' 40' ' ' LEU . 27.0 mt -92.73 115.55 28.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.57 -173.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -76.73 108.94 10.11 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 166.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.559 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 81.4 m95 -75.17 123.44 25.26 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.444 0.465 . . . . 0.0 109.818 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -63.76 -48.34 77.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.946 0.898 . . . . 0.0 111.72 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.06 2.5 88.25 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.292 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.545 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 76.9 m-85 -128.69 171.18 12.44 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.965 0.906 . . . . 0.0 109.879 -176.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 82.2 p -80.55 166.12 21.46 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -174.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -68.64 -27.95 66.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.098 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.2 -16.66 64.07 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.585 0.754 . . . . 0.0 111.256 174.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.24 -1.29 21.94 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.739 0.815 . . . . 0.0 111.208 -175.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -58.81 126.33 27.2 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.328 0.651 . . . . 0.0 111.351 175.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.4 p -129.06 150.63 50.37 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.049 0.54 . . . . 0.0 111.377 -174.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -76.94 118.25 19.33 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.792 0.837 . . . . 0.0 109.978 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -119.8 135.78 24.43 Favored Pre-proline 0 N--CA 1.471 0.593 0 C-N-CA 122.645 0.378 . . . . 0.0 110.249 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.566 ' HB3' ' HD2' ' A' ' 17' ' ' LYS . 37.1 Cg_endo -64.71 159.57 44.61 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.7 2.267 . . . . 0.0 113.667 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -54.69 -37.2 65.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.114 1.366 . . . . 0.0 111.858 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.402 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 15.9 pt-20 -72.98 -22.14 60.74 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.836 1.254 . . . . 0.0 111.602 -177.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.413 ' HB2' ' HG2' ' A' ' 36' ' ' PRO . 50.2 t30 -90.79 -17.72 26.15 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 124.327 1.051 . . . . 0.0 110.825 -175.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.525 HD22 HD11 ' A' ' 22' ' ' LEU . 11.1 mt -76.84 129.88 36.85 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.117 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -104.82 17.67 23.7 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 170.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.416 ' SG ' ' HB3' ' A' ' 40' ' ' LEU . 10.8 p -116.71 90.03 30.28 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.601 1.16 . . . . 0.0 109.629 -175.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -80.71 -27.49 3.19 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 122.748 2.299 . . . . 0.0 112.857 -178.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -27.79 61.71 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.39 0.676 . . . . 0.0 110.366 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.491 HD21 ' HG2' ' B' ' 5' ' ' GLN . 34.5 mt -71.73 -40.01 69.72 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.268 0.355 . . . . 0.0 111.088 174.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.51 -43.61 98.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.87 -45.96 80.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.598 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.32 -31.8 73.12 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.144 -176.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 68.6 t80 -62.1 -47.87 82.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.638 0.775 . . . . 0.0 110.167 175.793 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 98.7 mt -62.34 -45.95 90.88 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.3 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -68.15 -24.88 65.04 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.386 0.674 . . . . 0.0 111.327 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 N--CA 1.476 0.827 0 C-N-CA 123.072 0.549 . . . . 0.0 110.664 -176.978 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.526 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 0.8 OUTLIER . . . . . 0 N--CA 1.47 0.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 . . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 4.2 t -85.77 138.67 31.92 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.978 0.894 . . . . 0.0 112.577 -168.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -154.45 160.12 41.43 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 124.819 1.247 . . . . 0.0 108.166 170.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.44 ' HA ' ' HD2' ' A' ' 3' ' ' PHE . 0.1 OUTLIER . . . . . 0 C--O 1.243 0.756 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.092 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 . . . . . 0 N--CA 1.481 1.112 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.49 134.68 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-O 120.846 0.355 . . . . 0.0 110.063 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.429 HG21 HD22 ' A' ' 22' ' ' LEU . 2.3 p -116.09 132.9 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.935 0.894 . . . . 0.0 109.966 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -63.51 -57.73 9.27 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.388 1.075 . . . . 0.0 109.351 174.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -171.88 168.44 6.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.116 0.966 . . . . 0.0 111.031 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.425 HG11 ' HD1' ' A' ' 20' ' ' TYR . 58.5 t -79.11 144.23 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 123.591 0.756 . . . . 0.0 109.482 172.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.6 mt -108.45 -43.34 4.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.286 1.034 . . . . 0.0 111.097 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.65 164.75 35.32 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.171 0.589 . . . . 0.0 110.081 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -129.74 144.52 51.33 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.234 1.014 . . . . 0.0 110.145 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -141.41 167.26 22.59 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.393 1.077 . . . . 0.0 109.953 176.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.1 t -126.4 108.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 168.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.27 126.46 61.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 66.55 -71.7 0.09 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.004 1.321 . . . . 0.0 111.123 -174.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.85 15.96 0.1 OUTLIER Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.914 176.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt -118.33 159.42 23.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.694 0.797 . . . . 0.0 109.711 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.8 t -101.29 118.84 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 123.237 0.615 . . . . 0.0 110.351 -179.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.713 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 38.8 mt-10 -104.88 161.25 14.35 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 121.604 0.716 . . . . 0.0 111.885 169.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.425 ' HD1' HG11 ' A' ' 8' ' ' VAL . 97.0 m-85 -135.69 128.17 30.51 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.036 1.334 . . . . 0.0 108.793 -177.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -77.67 107.24 10.02 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.435 HD11 HD22 ' A' ' 40' ' ' LEU . 18.6 mt -91.17 122.38 33.76 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 122.38 0.272 . . . . 0.0 111.217 -172.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -77.26 103.36 7.15 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 164.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 94.1 m95 -73.04 139.77 46.8 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 122.613 0.365 . . . . 0.0 110.497 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -90.57 120.14 31.41 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.556 0.742 . . . . 0.0 109.173 -175.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.28 -35.23 4.71 Favored Glycine 0 N--CA 1.472 1.1 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 -175.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.491 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 65.2 m-85 -80.74 162.31 24.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.108 0.963 . . . . 0.0 109.851 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.4 p -82.38 173.09 12.36 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.849 0.46 . . . . 0.0 110.923 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.21 -16.84 62.53 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.97 0.508 . . . . 0.0 111.686 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.86 -19.66 60.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.412 0.685 . . . . 0.0 111.107 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -88.16 -19.1 27.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.328 0.651 . . . . 0.0 111.54 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -52.76 121.72 7.76 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 123.718 0.636 . . . . 0.0 111.774 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.41 158.47 44.34 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.83 0.852 . . . . 0.0 110.996 -172.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.48 109.74 16.98 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.752 0.821 . . . . 0.0 110.63 -178.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 45.1 mm-40 -112.39 124.66 31.53 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.144 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.713 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 27.7 Cg_endo -63.18 161.94 28.39 Favored 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.772 2.315 . . . . 0.0 112.589 175.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -29.36 35.15 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.426 1.09 . . . . 0.0 112.42 178.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.474 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.5 pt-20 -67.2 -31.34 71.65 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.068 0.947 . . . . 0.0 111.044 178.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -80.31 -30.18 38.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.927 0.891 . . . . 0.0 111.114 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.435 HD22 HD11 ' A' ' 22' ' ' LEU . 13.5 mt -73.14 116.06 13.22 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.556 0.342 . . . . 0.0 110.325 -174.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -87.22 -7.57 57.77 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' B' ' 5' ' ' GLN . 12.7 p -92.81 98.81 2.44 Favored Pre-proline 0 C--N 1.354 0.777 0 C-N-CA 125.034 1.334 . . . . 0.0 110.8 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.36 -26.51 8.76 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.21 1.94 . . . . 0.0 111.546 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -77.88 -30.3 50.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.875 1.27 . . . . 0.0 111.606 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 59.5 mt -77.16 -27.4 53.75 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.522 0.329 . . . . 0.0 111.359 177.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.418 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 58.1 mt -68.2 -53.05 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 172.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.05 -51.89 68.09 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.406 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -42.26 91.22 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 124.041 0.838 . . . . 0.0 111.362 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 70.2 t80 -60.07 -48.37 82.01 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 0.0 110.942 175.984 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 72.9 mt -65.81 -25.9 67.44 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.35 0.66 . . . . 0.0 111.218 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -80.44 -27.18 38.02 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.567 0.747 . . . . 0.0 111.592 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.3 m . . . . . 0 N--CA 1.484 1.26 0 CA-C-O 121.457 0.646 . . . . 0.0 109.974 -179.135 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.507 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 5.8 tp60 . . . . . 0 N--CA 1.472 0.66 0 CA-C-O 120.925 0.393 . . . . 0.0 110.065 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.406 ' H ' ' HG3' ' B' ' 5' ' ' GLN . 11.5 t -100.7 177.22 5.06 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 122.333 1.063 . . . . 0.0 111.341 -176.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.24 163.89 39.08 Favored 'General case' 0 C--O 1.247 0.969 0 C-N-CA 125.566 1.546 . . . . 0.0 107.785 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 . . . . . 0 C--N 1.323 -0.569 0 C-N-CA 124.396 1.078 . . . . 0.0 108.47 -172.637 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 . . . . . 0 N--CA 1.472 0.637 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.8 m -83.22 136.41 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 122.74 0.416 . . . . 0.0 110.1 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.457 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -117.25 129.68 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.935 0.894 . . . . 0.0 110.185 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -70.37 -56.69 6.07 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 124.464 1.106 . . . . 0.0 110.616 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -155.07 161.16 41.38 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.735 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.402 HG23 ' HB3' ' A' ' 45' ' ' LEU . 61.7 t -88.29 136.14 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-N 115.323 -0.853 . . . . 0.0 108.802 168.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -102.8 -50.7 3.47 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 110.696 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -150.75 168.09 25.45 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.283 0.633 . . . . 0.0 110.316 -169.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -134.2 142.81 47.53 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.543 1.137 . . . . 0.0 111.36 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -134.71 168.88 18.21 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.143 1.377 . . . . 0.0 108.756 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.92 110.78 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.43 0.692 . . . . 0.0 109.347 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 64.3 t -106.47 107.44 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.381 1.072 . . . . 0.0 110.066 176.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 57.24 43.31 23.93 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.77 1.228 . . . . 0.0 112.291 170.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.39 -25.2 23.84 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 115.614 -0.721 . . . . 0.0 113.226 177.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -91.24 151.45 20.92 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.102 0.961 . . . . 0.0 109.727 179.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.8 t -98.03 138.31 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.65 0.78 . . . . 0.0 109.743 177.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.608 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.2 mt-10 -121.28 166.48 13.96 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 167.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -137.1 152.52 50.1 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.576 1.15 . . . . 0.0 108.836 -177.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -92.5 109.28 20.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.512 HD11 HD21 ' A' ' 40' ' ' LEU . 10.4 mp -92.05 116.52 29.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.109 0.564 . . . . 0.0 110.844 -174.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tmtm? -76.36 99.66 4.91 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 105.695 -1.965 . . . . 0.0 105.695 165.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.655 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 94.2 m95 -70.16 135.17 48.87 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.421 0.451 . . . . 0.0 111.42 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -78.39 121.04 23.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.533 1.133 . . . . 0.0 109.923 -176.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.78 0.0 87.81 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 113.312 -176.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.468 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.8 m-85 -118.6 152.45 36.01 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.993 0.917 . . . . 0.0 110.044 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.0 t -77.66 163.66 26.0 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.401 0.68 . . . . 0.0 111.746 -173.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.425 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 m-20 -65.44 -31.69 72.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.752 0.821 . . . . 0.0 111.992 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.41 -18.75 65.23 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.502 0.721 . . . . 0.0 111.79 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -108.56 -5.64 16.42 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.169 0.987 . . . . 0.0 111.177 -176.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.655 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.6 m120 -66.37 132.7 48.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.582 0.353 . . . . 0.0 111.102 175.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 62.6 p -127.35 160.98 29.73 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.46 0.704 . . . . 0.0 111.41 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -84.45 122.66 29.29 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.998 175.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -120.9 137.61 26.73 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 123.012 0.525 . . . . 0.0 110.61 175.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.608 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 32.2 Cg_endo -64.05 161.54 33.03 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 122.397 2.065 . . . . 0.0 112.084 173.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -24.32 66.33 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.8 179.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.457 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 17.1 pt-20 -73.98 -22.44 59.62 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.732 0.813 . . . . 0.0 111.441 178.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -87.42 -15.94 36.3 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.423 0.689 . . . . 0.0 111.372 177.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.512 HD21 HD11 ' A' ' 22' ' ' LEU . 62.5 mt -72.85 116.39 13.29 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.595 0.358 . . . . 0.0 111.2 -176.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 6.81 42.98 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 18.4 p -106.36 92.68 7.18 Favored Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 125.264 1.425 . . . . 0.0 110.147 -178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -38.76 0.49 Allowed 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.605 2.203 . . . . 0.0 113.599 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.25 -21.21 59.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.815 0.446 . . . . 0.0 111.646 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.419 ' HG ' ' OE1' ' B' ' 5' ' ' GLN . 74.0 mt -73.25 -30.22 63.31 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.508 0.323 . . . . 0.0 111.275 174.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.4 mt -66.47 -46.53 86.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -62.86 -43.53 98.55 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.925 176.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.42 73.74 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.15 0.58 . . . . 0.0 110.915 -176.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -62.04 -43.57 98.56 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.059 0.944 . . . . 0.0 110.479 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.3 mt -71.18 -29.47 65.22 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.478 0.711 . . . . 0.0 110.291 178.116 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -76.55 -15.97 59.73 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.751 0.82 . . . . 0.0 111.189 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 29.7 m . . . . . 0 N--CA 1.478 0.963 0 C-N-CA 123.276 0.631 . . . . 0.0 110.393 172.799 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.419 ' OE1' ' HG ' ' A' ' 45' ' ' LEU . 5.3 tp-100 . . . . . 0 N--CA 1.476 0.863 0 CA-C-O 121.339 0.59 . . . . 0.0 110.568 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.04 176.66 7.45 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.456 -160.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -171.89 168.75 5.95 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.587 1.155 . . . . 0.0 109.473 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 . . . . . 0 N--CA 1.47 0.572 0 C-N-CA 124.145 0.978 . . . . 0.0 108.804 177.259 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 37.8 m-85 . . . . . 0 N--CA 1.478 0.967 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.513 ' HA ' HG22 ' B' ' 6' ' ' THR . 7.5 p -83.35 136.41 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.306 0.574 . . . . 0.0 111.579 -173.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.47 HG21 HD22 ' A' ' 22' ' ' LEU . 1.5 p -118.02 126.84 75.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.253 1.021 . . . . 0.0 109.445 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.25 -51.82 68.32 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.188 1.395 . . . . 0.0 111.514 174.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -170.77 165.54 7.98 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.73 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.472 HG11 ' HD2' ' A' ' 20' ' ' TYR . 98.0 t -82.26 133.59 28.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.596 168.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.9 mt -99.98 -38.47 8.58 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.468 0.707 . . . . 0.0 110.429 -178.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -153.62 163.6 39.7 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.85 0.46 . . . . 0.0 110.575 -174.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.0 ttt-85 -132.57 145.06 50.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.721 1.209 . . . . 0.0 109.329 -178.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -144.63 163.26 34.48 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.861 0.864 . . . . 0.0 109.655 176.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.471 HG22 HG22 ' A' ' 18' ' ' VAL . 88.3 t -122.23 109.49 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.612 0.765 . . . . 0.0 108.941 175.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.2 t -113.54 115.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.649 1.179 . . . . 0.0 109.701 177.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 64.73 27.71 13.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.839 1.256 . . . . 0.0 112.012 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.15 -11.82 66.24 Favored Glycine 0 N--CA 1.472 1.071 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.121 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -86.3 146.42 26.51 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.471 HG22 HG22 ' A' ' 13' ' ' VAL . 98.4 t -107.16 121.92 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.32 0.648 . . . . 0.0 109.453 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 48.5 mt-10 -112.84 155.91 23.82 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.048 0.939 . . . . 0.0 109.597 177.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.472 ' HD2' HG11 ' A' ' 8' ' ' VAL . 96.4 m-85 -132.92 129.45 38.34 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.469 1.108 . . . . 0.0 108.711 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -76.88 107.76 9.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.47 HD22 HG21 ' A' ' 5' ' ' VAL . 16.6 mt -87.51 122.73 31.61 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.9 -175.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -76.24 93.17 3.36 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 165.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.56 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 85.6 m95 -65.22 117.61 8.05 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -70.54 -43.46 69.49 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.308 0.643 . . . . 0.0 110.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.16 13.6 64.48 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.895 -0.593 . . . . 0.0 113.784 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -136.78 161.69 35.28 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.159 0.984 . . . . 0.0 109.801 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.3 p -68.24 159.74 30.62 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.756 0.822 . . . . 0.0 111.795 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.51 -38.27 89.19 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.055 -174.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.66 -19.86 65.96 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.341 0.657 . . . . 0.0 111.877 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -96.43 -2.11 46.11 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 123.933 0.893 . . . . 0.0 110.868 -178.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.56 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 1.5 m120 -64.94 129.08 38.42 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.631 0.773 . . . . 0.0 110.394 172.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 p -138.64 158.72 43.72 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.305 0.642 . . . . 0.0 112.01 -169.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -80.79 121.07 25.47 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.636 1.174 . . . . 0.0 111.147 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.487 ' HB2' HD21 ' A' ' 40' ' ' LEU . 49.3 mm-40 -122.59 134.01 24.72 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 123.425 0.69 . . . . 0.0 110.552 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 69.7 Cg_endo -70.6 154.86 64.15 Favored 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.778 2.319 . . . . 0.0 111.813 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.29 -28.39 62.98 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.407 1.083 . . . . 0.0 113.31 -175.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.92 -37.71 82.0 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.066 0.946 . . . . 0.0 110.552 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.409 HD22 ' HB3' ' A' ' 35' ' ' GLU . 41.8 t30 -77.58 -23.21 50.02 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 110.604 -178.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.487 HD21 ' HB2' ' A' ' 35' ' ' GLU . 57.6 mt -75.02 137.41 41.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.939 -178.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -111.68 11.26 21.06 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.909 0.883 . . . . 0.0 109.643 176.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.2 p -115.54 90.96 27.52 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 123.813 0.845 . . . . 0.0 111.059 -175.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.31 -24.72 14.1 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.615 2.21 . . . . 0.0 111.897 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.84 -52.74 63.9 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.779 1.232 . . . . 0.0 110.926 176.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.16 -33.68 73.78 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.144 -175.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.409 HD11 HD13 ' A' ' 40' ' ' LEU . 47.7 mm -68.4 -46.68 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 122.759 0.424 . . . . 0.0 110.391 178.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.9 -53.96 52.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.825 0.85 . . . . 0.0 110.522 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.57 -46.69 88.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.835 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -61.99 -52.41 64.11 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.067 0.947 . . . . 0.0 111.93 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 96.7 mt -61.15 -33.6 73.66 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.435 0.694 . . . . 0.0 111.181 -177.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 95.4 m-20 -75.38 -37.77 60.35 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.428 0.691 . . . . 0.0 111.491 177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 61.8 m . . . . . 0 N--CA 1.486 1.36 0 C-N-CA 123.752 0.821 . . . . 0.0 112.234 -178.867 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 . . . . . 0 CA--C 1.538 0.487 0 CA-C-O 122.068 0.937 . . . . 0.0 110.43 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.513 HG22 ' HA ' ' A' ' 4' ' ' VAL . 40.8 p -134.01 175.18 9.71 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.817 1.247 . . . . 0.0 110.135 -177.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.21 161.37 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.633 1.173 . . . . 0.0 109.964 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.564 ' HD2' ' H ' ' B' ' 8' ' ' ARG . 0.1 OUTLIER . . . . . 0 N--CA 1.484 1.272 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 174.351 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 66.7 t80 . . . . . 0 N--CA 1.475 0.799 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.541 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 4.2 p -69.72 126.92 30.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 CA-C-O 121.353 0.597 . . . . 0.0 112.284 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.472 HG21 HD22 ' A' ' 22' ' ' LEU . 2.1 p -99.84 120.14 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.27 -57.96 8.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.733 1.613 . . . . 0.0 111.726 174.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -162.52 161.88 27.16 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.52 -174.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.5 t -85.49 130.65 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 168.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.7 mt -96.91 -38.54 9.78 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.887 0.875 . . . . 0.0 111.282 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -156.24 164.33 38.48 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.117 -169.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.568 ' HE ' HG11 ' A' ' 18' ' ' VAL . 41.8 ttt180 -134.94 144.33 47.39 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 0.0 110.577 -173.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -140.49 163.62 32.34 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.791 0.836 . . . . 0.0 109.798 176.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . 0.441 HG22 HG22 ' A' ' 18' ' ' VAL . 89.2 t -121.7 123.93 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . 0.444 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 2.6 p -139.21 123.25 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.032 0.933 . . . . 0.0 108.884 -177.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 60.77 22.49 12.48 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.276 1.03 . . . . 0.0 112.455 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.31 -8.15 77.61 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.878 -0.401 . . . . 0.0 113.994 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 15.0 ptpt -94.93 171.58 8.68 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.568 HG11 ' HE ' ' A' ' 11' ' ' ARG . 99.1 t -117.69 126.3 74.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 174.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.581 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 36.7 mt-10 -106.82 157.09 18.01 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.576 0.703 . . . . 0.0 109.721 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -126.61 127.44 45.23 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.441 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -77.06 108.85 10.43 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.472 HD22 HG21 ' A' ' 5' ' ' VAL . 49.8 mt -81.78 172.79 12.95 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.061 0.851 . . . . 0.0 111.102 -174.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -126.46 100.97 6.48 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.531 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 84.6 m95 -69.57 116.63 10.19 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -73.1 114.32 11.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 123.778 0.674 . . . . 0.0 110.173 -171.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 118.13 -29.26 6.56 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 -174.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -98.05 157.81 15.91 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.214 1.005 . . . . 0.0 111.256 179.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . 0.404 HG23 ' H ' ' A' ' 31' ' ' ASP . 9.1 t -74.26 160.77 30.66 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.598 178.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.475 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.7 m-20 -70.0 -19.04 63.35 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.147 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.02 -31.54 66.29 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.868 0.867 . . . . 0.0 110.578 173.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . 0.404 ' H ' HG23 ' A' ' 28' ' ' THR . 27.7 t70 -78.79 -30.7 45.65 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.366 0.666 . . . . 0.0 110.978 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.531 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.0 m120 -61.46 148.75 40.83 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.846 0.716 . . . . 0.0 112.423 -172.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.3 p -126.57 163.8 22.61 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.772 0.829 . . . . 0.0 111.286 -167.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.3 119.73 25.41 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 170.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -119.56 132.71 23.92 Favored Pre-proline 0 C--O 1.239 0.511 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 172.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.581 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 48.2 Cg_endo -67.11 160.0 49.46 Favored 'Trans proline' 0 C--N 1.366 1.455 0 C-N-CA 122.161 1.907 . . . . 0.0 112.333 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -55.69 -28.22 54.38 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.025 1.33 . . . . 0.0 112.204 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.473 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.0 pt-20 -75.5 -17.72 60.03 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.056 1.342 . . . . 0.0 111.731 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -107.97 -4.77 17.57 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.199 0.599 . . . . 0.0 111.331 -169.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.567 HD12 HD11 ' A' ' 46' ' ' ILE . 30.7 mt -87.05 158.2 19.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.15 0.58 . . . . 0.0 110.861 -177.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.54 9.76 25.23 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 166.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 23.0 p -117.43 90.61 35.28 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 123.069 0.548 . . . . 0.0 111.527 -172.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.75 -22.14 10.63 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.314 2.01 . . . . 0.0 111.079 166.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.28 -44.31 83.91 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.246 1.018 . . . . 0.0 111.593 177.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.81 -29.18 55.87 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.982 0.513 . . . . 0.0 110.963 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.567 HD11 HD12 ' A' ' 40' ' ' LEU . 72.0 mt -63.48 -54.28 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 172.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.51 -46.14 89.78 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.692 -176.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.2 90.2 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 123.747 0.655 . . . . 0.0 110.766 -177.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . 0.427 ' CE2' ' HB2' ' A' ' 11' ' ' ARG . 82.8 t80 -58.78 -48.5 81.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.044 0.538 . . . . 0.0 109.952 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.3 mt -65.56 -27.6 68.55 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.498 0.719 . . . . 0.0 111.557 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -82.5 -19.64 38.35 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.582 0.753 . . . . 0.0 111.981 175.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.5 m . . . . . 0 N--CA 1.48 1.035 0 C-N-CA 122.691 0.396 . . . . 0.0 110.321 177.585 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 . . . . . 0 CA--C 1.544 0.717 0 CA-C-O 120.52 0.2 . . . . 0.0 110.789 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 76.1 p -99.33 177.71 5.11 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.016 0.912 . . . . 0.0 112.532 -171.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -163.84 156.36 17.64 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.267 174.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 14.1 tpt180 . . . . . 0 N--CA 1.471 0.59 0 C-N-CA 123.249 0.62 . . . . 0.0 109.673 179.779 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 . . . . . 0 C--O 1.239 0.509 0 N-CA-C 109.871 -0.418 . . . . 0.0 109.871 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.4 p -80.53 123.82 37.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-O 121.468 0.651 . . . . 0.0 109.562 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.513 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -102.97 133.45 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.412 1.085 . . . . 0.0 109.358 175.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.622 ' HB2' ' HG3' ' A' ' 25' ' ' LYS . 34.3 tt0 -69.55 -49.15 57.02 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.474 0.71 . . . . 0.0 111.01 176.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HA ' HD22 ' A' ' 45' ' ' LEU . 21.1 ptmt -166.61 164.92 16.93 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.633 0.583 . . . . 0.0 111.607 -173.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.537 HG11 ' HD2' ' A' ' 20' ' ' TYR . 94.7 t -85.51 135.76 24.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.0 mt -100.48 -43.64 6.15 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.736 0.814 . . . . 0.0 110.137 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -148.92 164.86 33.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.343 -171.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.507 ' HE ' HG11 ' A' ' 18' ' ' VAL . 34.9 ttt180 -138.72 128.59 25.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.068 0.947 . . . . 0.0 109.485 -175.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 12' ' ' ARG . 3.0 ptm180 -124.41 162.31 24.15 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.934 0.894 . . . . 0.0 109.35 175.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -126.31 112.45 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.966 0.906 . . . . 0.0 108.768 177.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.0 m -120.45 125.2 73.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.113 0.965 . . . . 0.0 109.401 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 61.61 20.84 11.63 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.226 1.01 . . . . 0.0 112.108 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.8 -24.04 32.76 Favored Glycine 0 C--N 1.348 1.211 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.448 -176.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.8 ptmt -82.54 163.35 21.58 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.507 HG11 ' HE ' ' A' ' 11' ' ' ARG . 45.9 t -117.6 127.11 75.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 123.312 0.645 . . . . 0.0 110.186 -176.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.569 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 45.1 mt-10 -109.19 154.05 22.92 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.599 0.76 . . . . 0.0 109.586 170.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.537 ' HD2' HG11 ' A' ' 8' ' ' VAL . 63.8 m-85 -128.04 128.51 45.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.435 1.094 . . . . 0.0 108.669 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -78.51 107.89 11.49 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.2 mt -92.84 119.86 32.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.345 -171.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -75.87 93.33 3.18 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 167.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.626 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 87.1 m95 -68.51 134.79 50.6 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 178.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.622 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 26.4 mttm -67.64 134.23 50.79 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.863 0.727 . . . . 0.0 110.19 172.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.19 -33.95 4.12 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.842 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.427 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 79.7 m-85 -91.43 149.48 21.69 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.048 0.939 . . . . 0.0 110.509 -177.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 p -70.54 160.98 31.47 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.934 0.894 . . . . 0.0 111.795 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . 0.472 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 p-10 -65.54 -29.94 70.62 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.341 1.057 . . . . 0.0 111.872 -177.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.8 -27.02 57.78 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.541 0.736 . . . . 0.0 111.19 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -89.04 -11.96 42.67 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.65 0.78 . . . . 0.0 110.83 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.626 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -64.26 143.07 58.16 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 122.529 0.332 . . . . 0.0 110.479 174.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 34.2 p -132.94 160.85 35.87 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.191 0.596 . . . . 0.0 111.876 -168.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -82.24 122.23 27.65 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.78 173.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -121.08 130.18 24.96 Favored Pre-proline 0 C--O 1.239 0.533 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 171.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.569 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 23.6 Cg_endo -61.22 162.04 21.19 Favored 'Trans proline' 0 C--N 1.371 1.758 0 C-N-CA 122.339 2.026 . . . . 0.0 112.31 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -55.02 -26.32 36.42 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 125.555 1.542 . . . . 0.0 113.153 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -77.65 -28.22 51.2 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.825 1.25 . . . . 0.0 111.989 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.6 m-20 -77.63 -21.87 51.62 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.525 0.73 . . . . 0.0 111.517 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.0 mt -73.28 117.48 15.07 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 122.886 0.474 . . . . 0.0 110.412 -176.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -94.78 -3.84 48.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.391 0.676 . . . . 0.0 110.204 172.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 16.3 p -101.01 98.0 7.91 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.618 1.167 . . . . 0.0 110.893 -176.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -76.22 -25.19 10.27 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.623 2.215 . . . . 0.0 112.191 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -59.3 -47.99 83.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.549 1.14 . . . . 0.0 110.916 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 7' ' ' LYS . 91.7 mt -70.36 -34.49 72.67 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.656 -177.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.6 mt -66.0 -51.01 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.88 -51.41 69.81 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.932 0.893 . . . . 0.0 111.025 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.93 79.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.565 0.746 . . . . 0.0 112.23 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -71.77 -54.44 10.22 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 122.722 0.409 . . . . 0.0 110.489 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.94 -37.68 79.01 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.516 0.726 . . . . 0.0 112.208 -171.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -81.55 -16.77 50.67 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.682 0.393 . . . . 0.0 111.564 -177.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 t . . . . . 0 N--CA 1.478 0.949 0 C-N-CA 122.528 0.331 . . . . 0.0 110.824 175.723 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 . . . . . 0 CA--C 1.53 0.179 0 CA-C-O 121.782 0.801 . . . . 0.0 109.187 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.6 m -104.44 153.47 21.07 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 113.885 -1.507 . . . . 0.0 108.971 -176.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.09 140.24 17.5 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 15.1 ttt85 . . . . . 0 C--N 1.325 -0.474 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.637 178.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 83.5 t80 . . . . . 0 N--CA 1.473 0.698 0 N-CA-C 109.322 -0.622 . . . . 0.0 109.322 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 3.7 p -69.61 109.84 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.96 0.886 . . . . 0.0 111.193 176.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.473 HG21 HD22 ' A' ' 22' ' ' LEU . 1.7 p -76.85 140.5 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.223 171.082 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 35.1 tt0 -68.31 -59.51 3.14 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.408 0.683 . . . . 0.0 110.162 176.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -166.41 164.87 17.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.598 -176.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.458 HG23 ' HB3' ' A' ' 45' ' ' LEU . 91.6 t -83.72 137.3 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.089 0.955 . . . . 0.0 108.969 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.5 mt -110.01 -29.58 8.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.354 0.661 . . . . 0.0 110.805 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -160.31 165.33 31.5 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.691 0.396 . . . . 0.0 110.65 -173.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.2 ttt180 -139.01 134.86 33.61 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.109 1.364 . . . . 0.0 109.754 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -134.04 175.69 9.25 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.534 1.134 . . . . 0.0 109.493 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -125.23 114.67 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.594 0.758 . . . . 0.0 109.654 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 73.3 t -126.85 131.76 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 173.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 70.63 14.52 7.2 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.714 1.259 . . . . 0.0 110.924 -177.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.0 9.29 86.84 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 116.184 -0.462 . . . . 0.0 113.074 -173.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.25 155.54 23.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 56.2 t -96.4 119.98 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.72 0.808 . . . . 0.0 109.632 -171.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.644 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.6 mt-10 -119.56 138.5 53.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.417 0.687 . . . . 0.0 110.017 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -113.93 132.33 55.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.1 0.96 . . . . 0.0 110.25 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -78.12 107.82 10.97 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.473 HD22 HG21 ' A' ' 5' ' ' VAL . 39.9 mt -97.74 122.41 40.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.352 -171.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.5 tmtt? -79.89 113.69 18.24 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 161.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.7 m95 -82.75 139.02 33.84 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.119 0.568 . . . . 0.0 110.005 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . 0.522 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 59.2 tttp -62.67 -59.2 5.23 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.563 0.745 . . . . 0.0 112.009 -166.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.29 29.07 6.28 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 113.649 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.552 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 88.7 m-85 -135.69 167.37 21.27 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.407 1.083 . . . . 0.0 109.836 174.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.4 p -82.8 171.81 13.54 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.509 0.724 . . . . 0.0 111.869 -175.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -70.26 -30.23 67.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.604 0.762 . . . . 0.0 110.98 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.85 60.64 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.546 0.738 . . . . 0.0 111.101 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 10.9 t70 -94.59 10.89 33.02 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.396 -177.539 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.8 142.83 57.22 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.095 0.958 . . . . 0.0 111.662 174.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.9 p -141.33 155.61 45.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.609 0.764 . . . . 0.0 110.976 -176.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -87.29 111.26 20.87 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.787 0.835 . . . . 0.0 110.912 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -117.73 126.96 26.95 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.644 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.9 Cg_endo -67.01 157.22 62.8 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 122.497 2.131 . . . . 0.0 112.886 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -30.63 61.71 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.575 1.15 . . . . 0.0 112.885 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -67.43 -33.89 76.09 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.642 0.734 . . . . 0.0 110.346 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . 0.404 ' OD1' ' HB3' ' B' ' 8' ' ' ARG . 60.1 t30 -89.5 -18.92 25.75 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.854 1.262 . . . . 0.0 110.833 -175.229 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.566 HD12 HD11 ' A' ' 46' ' ' ILE . 23.3 mt -70.51 162.73 28.26 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.784 0.434 . . . . 0.0 110.655 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -137.07 34.21 2.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 24.4 p -147.76 95.01 4.29 Favored Pre-proline 0 C--N 1.355 0.818 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.497 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.86 -16.11 18.54 Favored 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.234 1.956 . . . . 0.0 111.323 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -60.5 -43.8 96.65 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.457 1.103 . . . . 0.0 111.218 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . 0.468 HD21 ' HG3' ' B' ' 5' ' ' GLN . 69.6 mt -72.95 -44.59 60.97 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.865 0.466 . . . . 0.0 111.787 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.566 HD11 HD12 ' A' ' 40' ' ' LEU . 63.4 mt -60.94 -45.16 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 123.819 0.699 . . . . 0.0 110.536 -176.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.51 -52.99 58.85 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.339 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.32 -32.5 66.77 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.696 0.798 . . . . 0.0 112.216 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -67.29 -42.95 82.91 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.647 1.179 . . . . 0.0 110.684 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 90.2 mt -75.84 -32.34 59.74 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.162 0.585 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.42 -26.68 60.22 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.277 1.031 . . . . 0.0 110.271 -179.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t . . . . . 0 CA--C 1.545 0.757 0 C-N-CA 123.842 0.857 . . . . 0.0 110.293 173.345 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.468 ' HG3' HD21 ' A' ' 45' ' ' LEU . 16.5 pm0 . . . . . 0 CA--C 1.551 1.001 0 CA-C-O 121.901 0.858 . . . . 0.0 109.373 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 14.8 p -113.29 169.39 8.98 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.173 0.989 . . . . 0.0 111.133 -175.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.47 159.28 19.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 123.79 0.836 . . . . 0.0 109.176 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . 0.404 ' HB3' ' OD1' ' A' ' 39' ' ' ASN . 32.8 ttm-85 . . . . . 0 CA--C 1.538 0.483 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -175.95 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 . . . . . 0 N--CA 1.47 0.566 0 CA-C-O 121.412 0.625 . . . . 0.0 109.377 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.2 p -83.81 135.91 23.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.607 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . 0.507 HG21 ' HG ' ' A' ' 22' ' ' LEU . 1.5 p -112.99 130.7 66.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.77 -63.87 1.01 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.252 1.021 . . . . 0.0 110.171 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -165.05 169.68 16.0 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.767 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.593 HG11 ' HD2' ' A' ' 20' ' ' TYR . 99.8 t -83.08 144.64 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.815 171.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.44 -31.63 7.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.754 0.822 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -154.23 161.84 41.56 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -176.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . 0.411 HH21 HG11 ' A' ' 18' ' ' VAL . 47.9 ttt180 -133.76 141.37 47.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.471 0.708 . . . . 0.0 109.223 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -148.25 171.43 15.97 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.955 0.502 . . . . 0.0 110.4 178.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -119.79 120.82 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 123.76 0.824 . . . . 0.0 109.216 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.1 t -131.62 126.49 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.21 1.004 . . . . 0.0 108.703 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.5 m120 67.23 18.06 10.31 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.938 1.295 . . . . 0.0 111.267 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.56 -18.05 48.66 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.561 -172.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -78.26 162.71 26.34 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.622 0.769 . . . . 0.0 110.128 -177.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . 0.411 HG11 HH21 ' A' ' 11' ' ' ARG . 82.4 t -107.81 106.93 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 0.0 109.391 -175.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.562 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 89.8 mt-10 -105.14 152.86 22.29 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.327 0.651 . . . . 0.0 111.225 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.593 ' HD2' HG11 ' A' ' 8' ' ' VAL . 92.3 m-85 -132.53 136.5 46.67 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.074 1.35 . . . . 0.0 107.777 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -79.59 105.77 11.14 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 174.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.548 HD21 HD22 ' A' ' 40' ' ' LEU . 10.2 mp -86.88 113.53 22.75 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.398 0.679 . . . . 0.0 110.777 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtm? -72.84 97.65 2.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 168.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.575 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 83.6 m95 -65.1 123.43 19.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 174.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -64.95 115.49 5.43 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.398 1.061 . . . . 0.0 110.612 -172.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.08 -4.05 67.39 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 115.667 -0.697 . . . . 0.0 113.475 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.424 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 96.4 m-85 -109.7 142.25 41.15 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.964 0.905 . . . . 0.0 110.073 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 t -62.37 152.45 34.0 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.775 0.83 . . . . 0.0 111.643 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.84 -23.28 64.23 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.903 0.881 . . . . 0.0 112.747 -172.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.82 -31.16 64.6 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.902 0.481 . . . . 0.0 110.634 173.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -80.08 -30.2 39.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.706 0.802 . . . . 0.0 111.196 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.575 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -61.46 143.36 56.02 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.215 0.606 . . . . 0.0 111.195 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.9 p -126.97 169.28 13.48 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.206 0.602 . . . . 0.0 112.268 -164.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -88.25 114.66 25.09 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.743 0.817 . . . . 0.0 109.854 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.471 ' HB2' HD13 ' A' ' 22' ' ' LEU . 72.8 mm-40 -117.98 131.45 24.15 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 123.441 0.696 . . . . 0.0 109.766 173.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.562 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 67.8 Cg_endo -72.09 153.93 57.38 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 122.188 1.925 . . . . 0.0 112.18 174.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -30.68 63.37 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.192 0.997 . . . . 0.0 112.178 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.527 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 16.2 pt-20 -70.8 -8.81 55.17 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.397 1.079 . . . . 0.0 111.477 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -115.6 -7.28 12.19 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.159 0.983 . . . . 0.0 110.72 -174.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.548 HD22 HD21 ' A' ' 22' ' ' LEU . 14.1 mt -86.73 143.09 27.71 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.036 0.534 . . . . 0.0 112.04 -175.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -93.12 -6.45 47.97 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.048 0.539 . . . . 0.0 110.305 172.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . 0.548 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 21.2 p -107.15 98.47 22.4 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -175.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.9 -27.35 8.69 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.339 2.026 . . . . 0.0 111.666 173.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -61.21 -47.12 87.6 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 123.766 0.827 . . . . 0.0 111.154 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.13 -29.65 65.51 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.26 0.624 . . . . 0.0 111.762 -175.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.402 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 72.6 mt -66.19 -54.12 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -54.56 -53.51 53.52 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.326 1.05 . . . . 0.0 109.671 176.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -33.09 74.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.792 -168.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -65.86 -50.38 64.78 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.437 0.461 . . . . 0.0 110.246 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.402 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 72.6 mt -62.92 -32.13 73.35 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.841 0.713 . . . . 0.0 110.247 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -71.31 -39.33 71.51 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.825 1.25 . . . . 0.0 109.463 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.8 t . . . . . 0 N--CA 1.471 0.614 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.299 -177.743 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 2.2 mp0 . . . . . 0 N--CA 1.479 0.985 0 CA-C-O 121.47 0.652 . . . . 0.0 110.985 . . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 35.4 p -142.67 176.31 9.14 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 124.041 0.937 . . . . 0.0 109.338 178.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -166.26 174.4 9.2 Favored 'General case' 0 C--O 1.261 1.686 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.112 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 . . . . . 0 C--O 1.237 0.399 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -178.07 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 . . . . . 0 C--O 1.239 0.518 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.7 p -74.64 125.47 34.11 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.3 p -107.19 134.92 47.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.642 -177.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.95 -58.15 5.52 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.543 1.137 . . . . 0.0 110.547 177.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -164.17 167.24 20.34 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.883 -170.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' VAL . . . . . 0.439 HG13 ' HB3' ' A' ' 20' ' ' TYR . 65.2 t -94.18 141.5 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 169.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.4 mt -109.44 -38.39 5.48 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.076 0.95 . . . . 0.0 111.075 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -157.85 164.39 37.0 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.921 0.489 . . . . 0.0 110.218 -172.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -130.88 138.83 49.99 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.657 1.183 . . . . 0.0 110.045 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -132.88 163.04 30.01 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.281 1.032 . . . . 0.0 109.102 174.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.0 t -130.87 109.07 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 171.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 m -118.78 125.2 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.192 0.997 . . . . 0.0 110.6 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 58.51 25.99 13.75 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.658 1.183 . . . . 0.0 112.281 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.02 -16.87 58.53 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.286 -178.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' LYS . . . . . 0.406 ' HD2' ' HB3' ' A' ' 36' ' ' PRO . 6.3 ttpp -84.04 149.64 26.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.048 0.939 . . . . 0.0 109.42 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.8 t -115.98 114.44 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.82 0.848 . . . . 0.0 109.307 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' GLU . . . . . 0.663 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 40.4 mt-10 -110.43 155.23 22.49 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.154 0.502 . . . . 0.0 110.708 -179.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HB3' HG13 ' A' ' 8' ' ' VAL . 96.7 m-85 -128.36 130.23 47.42 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.246 1.018 . . . . 0.0 109.059 -177.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.67 107.39 11.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' LEU . . . . . 0.477 HD11 HD22 ' A' ' 40' ' ' LEU . 39.1 mt -95.87 129.48 43.11 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 122.843 0.457 . . . . 0.0 111.083 -171.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' LYS . . . . . 0.471 ' HG2' HD21 ' A' ' 32' ' ' ASN . 5.7 tmtm? -84.02 115.54 22.4 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 162.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' TRP . . . . . 0.553 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 82.1 m95 -79.71 130.37 35.29 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.725 0.41 . . . . 0.0 109.959 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -67.76 -46.13 72.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.188 0.595 . . . . 0.0 111.792 -167.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.17 20.36 50.48 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.409 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 86.6 m-85 -140.0 171.27 14.43 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.761 0.824 . . . . 0.0 111.152 -176.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.1 p -80.47 172.02 14.3 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.961 0.904 . . . . 0.0 112.777 -174.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.67 -27.67 63.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.434 1.094 . . . . 0.0 111.445 176.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.05 -22.72 62.09 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.207 0.603 . . . . 0.0 110.953 175.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -85.34 -20.15 30.39 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.283 1.033 . . . . 0.0 110.927 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' ASN . . . . . 0.471 HD21 ' HG2' ' A' ' 23' ' ' LYS . 11.0 m-20 -48.87 121.69 4.95 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.364 1.066 . . . . 0.0 111.643 176.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.46 158.13 45.16 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.268 0.627 . . . . 0.0 112.003 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -81.4 113.09 19.25 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.568 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' GLU . . . . . 0.471 ' HB2' HD21 ' A' ' 40' ' ' LEU . 46.3 mm-40 -117.43 129.07 25.59 Favored Pre-proline 0 CA--C 1.544 0.714 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' PRO . . . . . 0.663 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.6 Cg_endo -66.57 159.0 52.86 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 122.526 2.151 . . . . 0.0 113.287 177.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' GLU . . . . . 0.425 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -63.19 -28.31 69.96 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.654 0.781 . . . . 0.0 112.323 -177.532 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' GLU . . . . . 0.529 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.0 pt-20 -68.36 -20.68 64.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.156 0.982 . . . . 0.0 111.27 175.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 67.2 t30 -103.91 -7.17 20.64 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.618 1.167 . . . . 0.0 110.293 -175.056 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.477 HD22 HD11 ' A' ' 22' ' ' LEU . 18.5 mt -89.51 137.31 32.44 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.206 0.602 . . . . 0.0 110.838 178.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -100.07 -3.01 32.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.39 0.676 . . . . 0.0 109.438 170.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.7 p -106.57 91.75 6.35 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.141 0.976 . . . . 0.0 110.618 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.31 -14.28 4.89 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.423 2.082 . . . . 0.0 112.501 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -70.44 -44.11 68.5 Favored 'General case' 0 C--O 1.215 -0.744 0 C-N-CA 123.825 0.85 . . . . 0.0 109.843 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.21 -33.59 76.37 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.509 0.724 . . . . 0.0 111.01 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 75.2 mt -64.41 -55.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 174.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.26 -45.49 80.06 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.091 0.956 . . . . 0.0 111.326 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.11 -42.39 99.17 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.237 1.015 . . . . 0.0 110.802 -177.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.8 t80 -60.31 -50.48 73.46 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.694 174.577 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 81.5 mt -62.06 -36.49 81.8 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.802 0.841 . . . . 0.0 111.255 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.32 -40.09 62.44 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 110.39 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.0 m . . . . . 0 N--CA 1.478 0.951 0 C-N-CA 123.342 0.657 . . . . 0.0 112.563 -178.533 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 . . . . . 0 C--O 1.243 0.755 0 CA-C-O 121.934 0.873 . . . . 0.0 110.148 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 36.3 p -126.28 177.56 6.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.321 -1.308 . . . . 0.0 109.861 -177.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.93 171.83 16.17 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.134 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 . . . . . 0 C--N 1.319 -0.75 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 -174.015 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.442 0 N-CA-C 112.218 -0.353 . . . . 0.0 112.218 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -100.67 108.74 20.68 Favored 'General case' 0 C--O 1.24 0.555 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 174.207 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 41.5 m-85 -106.62 147.66 29.24 Favored 'General case' 0 N--CA 1.47 0.57 0 C-N-CA 123.346 0.658 . . . . 0.0 110.24 -172.593 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.3 p -78.5 119.67 27.98 Favored 'Isoleucine or valine' 0 C--O 1.242 0.7 0 C-N-CA 123.153 0.581 . . . . 0.0 110.354 179.434 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.475 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.5 p -93.24 137.55 22.24 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.565 0 CA-C-N 115.178 -0.919 . . . . 0.0 109.566 172.075 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.1 tt0 -80.15 -51.5 8.9 Favored 'General case' 0 N--CA 1.472 0.63 0 C-N-CA 123.614 0.766 . . . . 0.0 110.829 177.834 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 19.4 ptmt -161.25 169.45 22.16 Favored 'General case' 0 N--CA 1.482 1.159 0 O-C-N 123.671 0.607 . . . . 0.0 111.511 -171.839 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.416 HG11 ' HD2' ' A' ' 20' ' ' TYR . 58.6 t -100.19 143.12 14.32 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.816 0 C-N-CA 123.706 0.802 . . . . 0.0 109.286 172.473 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.437 HD12 HD22 ' A' ' 32' ' ' ASN . 72.4 mt -108.52 -39.2 5.47 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 124.218 1.007 . . . . 0.0 111.429 178.574 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 18.4 t70 -154.02 166.4 33.13 Favored 'General case' 0 N--CA 1.491 1.592 0 C-N-CA 122.755 0.422 . . . . 0.0 110.957 -174.2 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.575 HH11 HD21 ' A' ' 50' ' ' LEU . 53.5 ttt180 -142.2 148.73 38.67 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.738 1.215 . . . . 0.0 110.36 -179.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 14.7 ptm180 -152.36 174.56 13.68 Favored 'General case' 0 N--CA 1.478 0.948 0 C-N-CA 124.723 1.209 . . . . 0.0 109.25 173.958 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.586 HG22 HG22 ' A' ' 18' ' ' VAL . 94.6 t -123.11 116.03 47.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.895 0 C-N-CA 123.667 0.787 . . . . 0.0 109.796 175.65 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 96.4 t -118.56 121.24 66.55 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 C-N-CA 124.074 0.949 . . . . 0.0 109.369 176.885 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 76.7 m-20 64.05 23.6 13.29 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.86 1.264 . . . . 0.0 112.252 176.297 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.51 -23.35 32.64 Favored Glycine 0 CA--C 1.531 1.072 0 CA-C-N 115.928 -0.578 . . . . 0.0 113.444 -177.795 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -81.89 157.33 24.39 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.942 0.897 . . . . 0.0 109.116 176.328 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.586 HG22 HG22 ' A' ' 13' ' ' VAL . 99.4 t -113.08 114.29 46.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.812 0 C-N-CA 123.476 0.71 . . . . 0.0 109.438 -173.981 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.54 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -109.39 134.37 51.91 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.631 0.773 . . . . 0.0 110.562 -177.801 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.416 ' HD2' HG11 ' A' ' 8' ' ' VAL . 48.8 m-85 -108.77 128.46 54.9 Favored 'General case' 0 CA--C 1.533 0.297 0 C-N-CA 124.055 0.942 . . . . 0.0 109.774 -179.592 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.1 t80 -76.92 108.37 9.92 Favored 'General case' 0 C--O 1.223 -0.303 0 N-CA-C 106.94 -1.504 . . . . 0.0 106.94 173.615 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.428 ' O ' ' HB2' ' A' ' 32' ' ' ASN . 57.8 mt -82.8 -174.71 5.4 Favored 'General case' 0 CA--C 1.532 0.26 0 CA-C-O 121.547 0.689 . . . . 0.0 112.236 -171.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 11.1 tmtt? -144.71 112.91 6.47 Favored 'General case' 0 CA--C 1.533 0.301 0 N-CA-C 103.947 -2.612 . . . . 0.0 103.947 163.96 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.475 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 87.5 m95 -79.03 147.75 32.73 Favored 'General case' 0 N--CA 1.471 0.593 0 CA-C-O 121.012 0.434 . . . . 0.0 111.411 -173.834 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.476 ' HE3' ' HA ' ' A' ' 25' ' ' LYS . 0.2 OUTLIER -85.1 -36.21 21.3 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 115.07 -0.968 . . . . 0.0 109.506 172.525 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -73.19 -28.98 65.17 Favored Glycine 0 C--N 1.357 1.696 0 CA-C-N 115.917 -0.583 . . . . 0.0 113.317 179.103 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 85.9 m-85 -120.43 171.91 8.19 Favored 'General case' 0 N--CA 1.485 1.304 0 C-N-CA 123.769 0.828 . . . . 0.0 110.956 -174.737 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.6 p -70.65 161.78 30.14 Favored 'General case' 0 CA--C 1.553 1.086 0 C-N-CA 123.182 0.593 . . . . 0.0 111.489 -178.745 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.2 p-10 -68.72 -27.09 65.63 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.4 0.68 . . . . 0.0 112.109 -173.137 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -84.46 -19.02 34.05 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.449 0.7 . . . . 0.0 111.263 177.35 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 21.6 t70 -83.53 1.62 41.05 Favored 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 123.37 0.668 . . . . 0.0 110.886 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.474 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 31.1 p-10 -56.96 146.98 25.1 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 124.368 1.067 . . . . 0.0 112.718 175.587 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.439 HG21 HM32 ' B' ' 9' ' ' M3L . 7.2 p -140.9 158.71 43.57 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.459 -0.792 . . . . 0.0 111.4 -173.294 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -76.95 115.95 17.19 Favored 'General case' 0 N--CA 1.471 0.607 0 C-N-CA 124.111 0.965 . . . . 0.0 110.31 176.108 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 52.3 mm-40 -124.56 131.3 24.14 Favored Pre-proline 0 CA--C 1.536 0.424 0 N-CA-C 109.456 -0.572 . . . . 0.0 109.456 175.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.554 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . 63.8 Cg_endo -70.85 154.61 63.33 Favored 'Trans proline' 0 C--N 1.365 1.395 0 C-N-CA 122.439 2.092 . . . . 0.0 112.438 -179.413 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.94 -28.34 56.45 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 124.469 1.107 . . . . 0.0 112.289 178.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.554 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.3 pt-20 -66.27 -31.92 73.02 Favored 'General case' 0 CA--C 1.553 1.072 0 O-C-N 123.664 0.603 . . . . 0.0 111.279 177.524 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.403 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 3.1 m-20 -93.9 -18.47 21.93 Favored 'General case' 0 N--CA 1.484 1.243 0 C-N-CA 123.942 0.897 . . . . 0.0 111.593 177.925 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.43 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 61.1 mt -76.75 124.86 28.31 Favored 'General case' 0 N--CA 1.469 0.499 0 N-CA-C 109.522 -0.548 . . . . 0.0 109.522 176.936 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 18.6 t70 -103.48 23.82 12.0 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.836 -0.801 . . . . 0.0 108.836 171.258 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.508 ' HB3' ' HB3' ' B' ' 5' ' ' GLN . 21.3 p -112.52 89.67 13.19 Favored Pre-proline 0 CA--C 1.549 0.939 0 C-N-CA 123.942 0.897 . . . . 0.0 110.505 -179.804 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 11.6 Cg_exo -73.63 -33.02 7.08 Favored 'Trans proline' 0 C--N 1.378 2.11 0 C-N-CA 122.888 2.392 . . . . 0.0 111.814 173.635 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 39.5 tt0 -56.96 -50.21 73.34 Favored 'General case' 0 CA--C 1.543 0.697 0 CA-C-N 114.559 -1.201 . . . . 0.0 111.418 179.25 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.422 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 77.8 mt -70.22 -36.84 74.83 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 115.753 -0.658 . . . . 0.0 111.599 -175.708 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 56.1 mt -65.2 -49.7 77.68 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 C-N-CA 122.803 0.441 . . . . 0.0 110.405 178.406 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -57.97 -50.63 72.72 Favored 'General case' 0 N--CA 1.479 1.02 0 O-C-N 123.573 0.546 . . . . 0.0 110.626 177.988 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -60.62 -38.76 85.81 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 124.056 0.848 . . . . 0.0 111.457 -176.992 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.0 t80 -64.06 -42.92 96.85 Favored 'General case' 0 CA--C 1.553 1.063 0 C-N-CA 123.733 0.813 . . . . 0.0 111.508 177.935 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.575 HD21 HH11 ' A' ' 11' ' ' ARG . 84.2 mt -68.52 -35.46 77.5 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.092 0.557 . . . . 0.0 110.396 179.211 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 94.0 m-20 -66.4 -31.34 72.04 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 124.136 0.974 . . . . 0.0 110.948 175.072 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.8 m -69.72 -38.86 77.06 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.377 0.671 . . . . 0.0 110.833 177.276 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 47.9 mt-30 -71.98 -27.69 62.92 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.386 0.674 . . . . 0.0 111.543 -179.555 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 27.4 mtpp . . . . . 0 C--O 1.254 1.295 0 CA-C-O 118.568 -0.73 . . . . 0.0 109.335 -178.834 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.27 0 CA-C-O 120.502 0.191 . . . . 0.0 111.24 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 13.1 mmt180 -97.31 104.22 16.22 Favored 'General case' 0 N--CA 1.474 0.734 0 C-N-CA 123.418 0.687 . . . . 0.0 110.3 179.401 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 52.3 p -85.53 86.82 7.35 Favored 'General case' 0 CA--C 1.539 0.552 0 CA-C-N 115.31 -0.859 . . . . 0.0 110.31 -179.42 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 96.9 mttt -100.04 131.21 46.14 Favored 'General case' 0 C--O 1.239 0.525 0 CA-C-N 115.703 -0.68 . . . . 0.0 109.999 175.825 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.508 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 28.7 mm-40 -123.42 137.83 54.72 Favored 'General case' 0 CA--C 1.532 0.276 0 C-N-CA 124.254 1.022 . . . . 0.0 108.662 174.351 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 28.2 p -97.71 147.38 24.42 Favored 'General case' 0 C--O 1.24 0.583 0 C-N-CA 123.391 0.676 . . . . 0.0 111.215 -175.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.12 144.02 24.53 Favored 'General case' 0 N--CA 1.469 0.522 0 C-N-CA 124.145 0.978 . . . . 0.0 109.845 176.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.403 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 16.1 mtp180 -106.74 130.66 54.42 Favored 'General case' 0 N--CA 1.469 0.498 0 C-N-CA 124.182 0.993 . . . . 0.0 108.69 -178.115 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.439 HM32 HG21 ' A' ' 33' ' ' THR . . . . . . . . 0 N--CA 1.469 0.491 0 CA-C-O 121.054 0.454 . . . . 0.0 110.761 179.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 27.0 t -72.05 84.81 1.0 Allowed 'General case' 0 C--O 1.242 0.704 0 C-N-CA 124.751 1.22 . . . . 0.0 110.165 178.965 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 30.6 p -78.77 86.5 4.7 Favored 'General case' 0 CA--C 1.539 0.539 0 CA-C-N 115.196 -0.911 . . . . 0.0 108.696 175.563 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 101.78 -157.35 18.69 Favored Glycine 0 C--N 1.342 0.914 0 CA-C-N 115.456 -0.793 . . . . 0.0 111.44 -171.176 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -172.04 112.86 0.46 Allowed Glycine 0 C--N 1.344 1.02 0 N-CA-C 110.465 -1.054 . . . . 0.0 110.465 -177.588 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . 0.531 ' HE3' ' HA ' ' B' ' 14' ' ' LYS . 0.8 OUTLIER -73.81 89.0 1.81 Allowed 'General case' 0 N--CA 1.475 0.819 0 C-N-CA 122.967 0.507 . . . . 0.0 110.503 -176.132 . . . . . . . . 3 3 . 1 . 001 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.549 0.911 0 N-CA-C 108.563 -0.903 . . . . 0.0 108.563 174.206 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 1.222 0 N-CA-C 111.601 -0.6 . . . . 0.0 111.601 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.464 ' HA ' ' HA ' ' B' ' 8' ' ' ARG . 4.9 mp0 -91.14 147.05 23.33 Favored 'General case' 0 C--O 1.243 0.735 0 C-N-CA 123.905 0.882 . . . . 0.0 108.963 178.009 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 33.1 t80 -145.98 155.53 42.89 Favored 'General case' 0 CA--C 1.541 0.616 0 C-N-CA 123.444 0.698 . . . . 0.0 109.394 -178.82 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 5.0 m -71.42 109.71 3.86 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.694 0 C-N-CA 123.544 0.738 . . . . 0.0 111.887 178.629 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.528 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.7 p -85.11 137.48 20.76 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.616 0 N-CA-C 108.643 -0.873 . . . . 0.0 108.643 165.141 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 31.4 tt0 -76.74 -54.64 6.36 Favored 'General case' 0 C--O 1.239 0.538 0 C-N-CA 123.199 0.6 . . . . 0.0 110.311 177.699 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.44 ' HA ' HD13 ' A' ' 45' ' ' LEU . 19.3 ptmt -160.28 164.94 32.23 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.001 0.52 . . . . 0.0 111.97 177.76 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.439 HG11 ' HD2' ' A' ' 20' ' ' TYR . 89.6 t -86.73 134.58 27.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 C-N-CA 124.356 1.062 . . . . 0.0 109.614 171.977 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 87.2 mt -101.6 -39.15 7.62 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.507 0.723 . . . . 0.0 110.887 178.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 9.7 t70 -149.41 165.37 32.27 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 122.518 0.327 . . . . 0.0 110.696 -172.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 40.1 ttt180 -132.97 144.03 49.85 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.277 1.031 . . . . 0.0 109.154 -178.568 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 33.7 ptt180 -150.34 172.44 15.38 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.778 0.831 . . . . 0.0 109.684 177.108 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 18' ' ' VAL . 76.5 t -127.5 121.95 58.26 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.656 0 C-N-CA 124.302 1.041 . . . . 0.0 108.976 175.2 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.468 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 69.2 t -129.38 125.79 62.48 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.945 0 N-CA-C 108.514 -0.921 . . . . 0.0 108.514 179.001 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 78.1 m-20 63.96 20.0 12.01 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.412 1.085 . . . . 0.0 112.332 175.736 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.79 -12.86 62.63 Favored Glycine 0 C--N 1.348 1.244 0 CA-C-O 119.949 -0.362 . . . . 0.0 113.974 -179.316 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.468 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptpt -98.4 165.32 11.9 Favored 'General case' 0 N--CA 1.482 1.159 0 CA-C-N 117.404 0.602 . . . . 0.0 109.459 178.97 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.523 HG22 HG22 ' A' ' 13' ' ' VAL . 56.5 t -107.96 119.37 57.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.792 0 C-N-CA 123.12 0.568 . . . . 0.0 109.685 178.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.535 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.7 mt-10 -110.16 139.0 45.77 Favored 'General case' 0 N--CA 1.474 0.727 0 C-N-CA 123.406 0.682 . . . . 0.0 110.211 178.425 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HD2' HG11 ' A' ' 8' ' ' VAL . 61.7 m-85 -111.57 140.68 45.98 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 123.659 0.784 . . . . 0.0 110.11 179.956 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 7.7 t80 -79.08 108.04 12.29 Favored 'General case' 0 N--CA 1.465 0.305 0 N-CA-C 108.592 -0.892 . . . . 0.0 108.592 177.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.469 HD22 HG21 ' A' ' 5' ' ' VAL . 23.2 mt -95.37 120.47 35.67 Favored 'General case' 0 C--O 1.236 0.374 0 C-N-CA 123.115 0.566 . . . . 0.0 110.757 -174.883 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.757 ' HD3' ' HA ' ' A' ' 29' ' ' ASP . 0.0 OUTLIER -91.62 113.03 25.19 Favored 'General case' 0 CA--C 1.538 0.512 0 N-CA-C 107.012 -1.477 . . . . 0.0 107.012 166.33 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.528 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 68.9 m95 -79.06 150.12 31.94 Favored 'General case' 0 N--CA 1.474 0.768 0 C-N-CA 123.817 0.847 . . . . 0.0 111.03 -173.541 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 35.9 ttpt -88.79 -39.37 13.95 Favored 'General case' 0 N--CA 1.471 0.591 0 C-N-CA 122.944 0.498 . . . . 0.0 111.156 -175.822 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -72.67 -33.37 60.66 Favored Glycine 0 C--N 1.348 1.247 0 CA-C-N 116.049 -0.523 . . . . 0.0 112.217 177.804 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.0 m-85 -94.03 162.44 13.88 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.398 0.679 . . . . 0.0 110.289 174.089 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 53.1 p -72.36 172.11 10.97 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.507 0.723 . . . . 0.0 111.631 -177.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.757 ' HA ' ' HD3' ' A' ' 23' ' ' LYS . 1.2 m-20 -69.44 -17.59 63.65 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.281 0.632 . . . . 0.0 110.919 173.341 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.75 -19.09 60.37 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.778 0.831 . . . . 0.0 111.7 173.787 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -121.78 85.36 2.4 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-O 121.634 0.731 . . . . 0.0 109.466 -179.275 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.433 ' HB3' ' HA ' ' A' ' 23' ' ' LYS . 6.9 p30 -125.61 136.48 53.31 Favored 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 124.749 1.22 . . . . 0.0 110.179 173.674 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.42 HG21 HM22 ' B' ' 9' ' ' M3L . 64.2 p -130.85 154.79 47.68 Favored 'General case' 0 N--CA 1.485 1.308 0 C-N-CA 123.656 0.783 . . . . 0.0 111.114 -173.375 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.7 m95 -80.84 123.68 28.46 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.967 0.907 . . . . 0.0 110.313 175.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.4 mm-40 -123.79 138.94 31.29 Favored Pre-proline 0 N--CA 1.476 0.854 0 C-N-CA 123.186 0.594 . . . . 0.0 109.563 171.482 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.535 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 60.9 Cg_endo -68.83 158.94 55.84 Favored 'Trans proline' 0 C--N 1.37 1.665 0 C-N-CA 122.726 2.284 . . . . 0.0 112.302 175.878 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.463 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 11.3 pt-20 -65.74 -26.05 67.56 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.106 0.562 . . . . 0.0 111.615 -175.816 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.482 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.9 pt-20 -62.07 -32.19 72.69 Favored 'General case' 0 N--CA 1.481 1.092 0 C-N-CA 123.959 0.904 . . . . 0.0 110.971 175.227 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.425 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 7.9 m-20 -80.09 -32.32 39.2 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.024 0.93 . . . . 0.0 110.85 176.913 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.465 ' CD2' HD11 ' A' ' 22' ' ' LEU . 13.4 mt -72.27 131.97 43.42 Favored 'General case' 0 N--CA 1.471 0.585 0 CA-C-N 116.357 -0.383 . . . . 0.0 110.055 -176.983 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.1 t70 -123.97 66.38 1.04 Allowed 'General case' 0 C--O 1.24 0.577 0 N-CA-C 107.631 -1.248 . . . . 0.0 107.631 171.925 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.688 ' SG ' ' HG2' ' B' ' 5' ' ' GLN . 36.2 t -152.6 112.07 2.77 Favored Pre-proline 0 CA--C 1.543 0.697 0 CA-C-N 114.38 -1.282 . . . . 0.0 110.353 -177.996 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 81.9 Cg_endo -78.71 -23.54 8.14 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.125 1.883 . . . . 0.0 111.885 168.314 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.5 tp10 -63.32 -58.7 6.27 Favored 'General case' 0 N--CA 1.474 0.764 0 C-N-CA 123.987 0.915 . . . . 0.0 111.872 -173.606 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.452 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 87.5 mt -72.18 -39.16 68.85 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.642 0.777 . . . . 0.0 112.285 -169.947 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.7 mt -65.41 -51.2 66.99 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.835 0 O-C-N 123.692 0.62 . . . . 0.0 110.406 -179.535 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.0 tt0 -66.0 -40.66 91.34 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.076 -179.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.29 -37.06 86.01 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 122.832 0.453 . . . . 0.0 111.019 179.755 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 65.6 t80 -61.13 -46.27 91.26 Favored 'General case' 0 N--CA 1.481 1.106 0 C-N-CA 123.783 0.833 . . . . 0.0 110.534 176.307 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.439 ' HA ' HE21 ' A' ' 53' ' ' GLN . 82.2 mt -68.48 -37.22 79.95 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.417 -0.81 . . . . 0.0 111.145 -178.797 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 93.6 m-20 -82.61 -14.86 54.05 Favored 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.635 0.774 . . . . 0.0 112.077 179.732 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.2 t -81.26 -24.05 37.58 Favored 'General case' 0 N--CA 1.485 1.29 0 C-N-CA 123.171 0.588 . . . . 0.0 109.901 174.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.439 HE21 ' HA ' ' A' ' 50' ' ' LEU . 48.7 mt-30 -70.37 -29.1 65.68 Favored 'General case' 0 N--CA 1.473 0.711 0 CA-C-N 115.666 -0.697 . . . . 0.0 109.896 171.205 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 29.6 mmmt . . . . . 0 CA--C 1.551 0.992 0 CA-C-O 118.66 -0.686 . . . . 0.0 110.994 176.28 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.276 0 N-CA-C 110.194 -0.298 . . . . 0.0 110.194 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.5 ptm180 -103.4 7.47 38.08 Favored 'General case' 0 N--CA 1.486 1.33 0 C-N-CA 123.667 0.787 . . . . 0.0 111.762 -179.78 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . 0.604 ' HB ' HE22 ' B' ' 5' ' ' GLN . 12.7 p -88.57 117.28 27.41 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 123.613 0.765 . . . . 0.0 112.042 -173.189 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 10.0 mptt -105.6 105.49 15.55 Favored 'General case' 0 N--CA 1.485 1.297 0 C-N-CA 123.246 0.618 . . . . 0.0 109.403 176.695 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.688 ' HG2' ' SG ' ' A' ' 42' ' ' CYS . 2.0 mp0 -127.75 127.7 44.06 Favored 'General case' 0 N--CA 1.476 0.873 0 C-N-CA 122.894 0.478 . . . . 0.0 109.887 176.702 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 54.1 m -72.06 117.78 14.11 Favored 'General case' 0 CA--C 1.541 0.618 0 C-N-CA 124.449 1.1 . . . . 0.0 109.707 177.372 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -137.67 110.81 7.82 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.05 0.54 . . . . 0.0 109.918 176.796 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.464 ' HA ' ' HA ' ' A' ' 2' ' ' GLU . 39.6 ttt180 -65.82 144.37 56.89 Favored 'General case' 0 CA--C 1.536 0.431 0 C-N-CA 124.548 1.139 . . . . 0.0 111.085 177.503 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.42 HM22 HG21 ' A' ' 33' ' ' THR . . . . . . . . 0 C--O 1.237 0.416 0 CA-C-N 116.224 -0.444 . . . . 0.0 109.993 169.341 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 29.6 t -75.97 81.42 2.84 Favored 'General case' 0 CA--C 1.541 0.601 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.174 176.34 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 76.7 p -80.91 -22.83 39.4 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 115.235 -0.893 . . . . 0.0 111.021 -177.456 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -130.44 75.1 0.43 Allowed Glycine 0 C--N 1.349 1.251 0 N-CA-C 111.904 -0.478 . . . . 0.0 111.904 -178.575 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -76.06 78.9 1.2 Allowed Glycine 0 C--N 1.347 1.186 0 N-CA-C 111.329 -0.708 . . . . 0.0 111.329 172.588 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 21.0 ptmt -153.1 169.84 21.96 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.613 0.765 . . . . 0.0 111.133 -170.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.209 0 C-N-CA 124.238 1.015 . . . . 0.0 108.484 176.433 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.526 ' HA2' ' HG2' ' B' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.48 1.588 0 N-CA-C 112.683 -0.167 . . . . 0.0 112.683 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 0.3 OUTLIER -153.85 -32.47 0.11 Allowed 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 124.083 0.953 . . . . 0.0 109.869 179.316 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 57.6 m-85 -69.99 151.81 45.15 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.299 0.639 . . . . 0.0 110.378 -177.202 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.47 HG13 ' O ' ' A' ' 25' ' ' LYS . 3.0 p -113.23 125.18 70.45 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.937 0 C-N-CA 123.124 0.57 . . . . 0.0 110.658 -174.554 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.586 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.1 p -114.88 140.04 38.02 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.809 0 C-N-CA 124.677 1.191 . . . . 0.0 110.405 -179.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 6.4 tp10 -73.24 -57.34 4.09 Favored 'General case' 0 C--N 1.349 0.564 0 CA-C-N 115.593 -0.731 . . . . 0.0 110.365 175.96 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.472 ' HA ' HD22 ' A' ' 45' ' ' LEU . 21.2 ptmt -164.2 162.57 22.76 Favored 'General case' 0 N--CA 1.477 0.921 0 CA-C-O 121.307 0.575 . . . . 0.0 112.368 -174.722 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.528 HG23 ' HB3' ' A' ' 45' ' ' LEU . 93.3 t -84.3 143.7 11.26 Favored 'Isoleucine or valine' 0 C--O 1.241 0.612 0 CA-C-N 114.649 -1.159 . . . . 0.0 108.857 169.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 80.1 mt -110.54 -42.57 4.05 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 123.236 0.614 . . . . 0.0 110.577 -179.689 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 35.4 t70 -151.77 164.86 36.1 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 122.84 0.456 . . . . 0.0 110.538 -171.871 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.4 ' HB2' ' HE2' ' A' ' 49' ' ' PHE . 77.3 ttt180 -124.18 159.54 29.87 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.415 1.086 . . . . 0.0 110.206 -174.941 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.5 ptm180 -159.43 167.09 29.59 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 123.634 0.774 . . . . 0.0 109.329 173.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -121.89 121.11 63.38 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.788 0 N-CA-C 108.622 -0.881 . . . . 0.0 108.622 176.266 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.522 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 89.9 t -125.3 114.85 41.77 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.736 0 C-N-CA 124.239 1.016 . . . . 0.0 109.041 -177.556 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 53.7 m-20 65.78 12.06 8.05 Favored 'General case' 0 N--CA 1.493 1.699 0 C-N-CA 124.329 1.051 . . . . 0.0 112.275 174.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 110.56 -25.04 16.06 Favored Glycine 0 CA--C 1.53 1.028 0 C-N-CA 123.315 0.484 . . . . 0.0 113.37 -174.698 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.522 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.8 ptpt -81.52 174.26 11.6 Favored 'General case' 0 N--CA 1.486 1.348 0 N-CA-C 109.193 -0.669 . . . . 0.0 109.193 178.911 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 85.1 t -120.79 123.77 70.95 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.611 0 N-CA-C 109.138 -0.69 . . . . 0.0 109.138 179.443 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.61 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 39.9 mt-10 -105.51 138.33 41.88 Favored 'General case' 0 N--CA 1.473 0.676 0 CA-C-O 121.228 0.537 . . . . 0.0 110.341 173.338 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.4 m-85 -111.84 136.66 50.83 Favored 'General case' 0 CA--C 1.539 0.549 0 C-N-CA 124.548 1.139 . . . . 0.0 109.171 176.666 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 5.4 t80 -80.21 105.56 11.57 Favored 'General case' 0 N--CA 1.462 0.165 0 N-CA-C 108.734 -0.839 . . . . 0.0 108.734 -177.517 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.433 HD22 HG21 ' A' ' 5' ' ' VAL . 23.5 mt -91.62 112.63 24.63 Favored 'General case' 0 C--O 1.236 0.37 0 CA-C-N 115.465 -0.789 . . . . 0.0 110.512 -175.973 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.412 ' HA ' ' HB3' ' A' ' 32' ' ' ASN . 0.1 OUTLIER -85.0 105.83 16.05 Favored 'General case' 0 CA--C 1.538 0.495 0 N-CA-C 106.483 -1.673 . . . . 0.0 106.483 165.727 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.586 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 80.3 m95 -73.84 154.01 39.66 Favored 'General case' 0 CA--C 1.536 0.44 0 C-N-CA 123.439 0.695 . . . . 0.0 112.039 -172.756 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.47 ' O ' HG13 ' A' ' 4' ' ' VAL . 25.4 ttpp -112.14 151.41 29.51 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 108.094 -1.076 . . . . 0.0 108.094 178.195 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.1 -48.32 4.01 Favored Glycine 0 N--CA 1.481 1.664 0 N-CA-C 111.65 -0.58 . . . . 0.0 111.65 -174.627 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 72.1 m-85 -66.96 165.62 15.21 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.201 1.0 . . . . 0.0 109.584 165.248 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 32.3 p -65.75 152.43 44.32 Favored 'General case' 0 CA--C 1.551 1.017 0 CA-C-O 120.812 0.339 . . . . 0.0 110.988 175.882 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 18.5 t70 -68.45 -31.56 70.95 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.641 0.776 . . . . 0.0 111.764 -169.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -78.38 -17.46 56.43 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.192 0.597 . . . . 0.0 111.597 176.495 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.1 t0 -84.59 65.32 8.96 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 123.856 0.862 . . . . 0.0 109.486 -178.718 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.563 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 16.2 p30 -111.03 149.08 31.24 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 125.006 1.322 . . . . 0.0 110.57 177.179 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 52.5 p -139.36 164.52 29.62 Favored 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 123.938 0.895 . . . . 0.0 110.476 -178.898 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -86.15 123.78 31.82 Favored 'General case' 0 N--CA 1.471 0.596 0 N-CA-C 108.669 -0.863 . . . . 0.0 108.669 169.496 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 67.2 mm-40 -124.72 133.69 24.99 Favored Pre-proline 0 N--CA 1.472 0.634 0 C-N-CA 122.818 0.447 . . . . 0.0 110.576 172.678 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.61 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 43.7 Cg_endo -65.77 160.61 42.88 Favored 'Trans proline' 0 C--N 1.366 1.485 0 C-N-CA 122.572 2.181 . . . . 0.0 112.384 176.691 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -60.18 -25.47 65.58 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 124.62 1.168 . . . . 0.0 112.021 179.253 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.437 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 13.0 pt-20 -68.68 -23.02 64.34 Favored 'General case' 0 CA--C 1.556 1.204 0 C-N-CA 123.282 0.633 . . . . 0.0 111.331 178.406 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 6.7 m-20 -89.98 -22.58 21.85 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 124.689 1.195 . . . . 0.0 111.488 -179.512 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.421 ' CD2' HD11 ' A' ' 22' ' ' LEU . 21.1 mt -77.79 117.0 18.74 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.901 0.48 . . . . 0.0 111.426 -172.024 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 2.7 m-20 -84.29 -27.56 27.74 Favored 'General case' 0 N--CA 1.477 0.914 0 N-CA-C 109.37 -0.604 . . . . 0.0 109.37 174.377 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.508 ' SG ' ' HG ' ' A' ' 45' ' ' LEU . 51.1 t -80.62 109.38 12.82 Favored Pre-proline 0 CA--C 1.546 0.803 0 C-N-CA 123.891 0.876 . . . . 0.0 110.714 178.747 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -79.07 -17.86 11.66 Favored 'Trans proline' 0 C--N 1.377 2.037 0 C-N-CA 122.274 1.983 . . . . 0.0 111.476 173.551 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.441 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 12.7 tp10 -65.52 -52.44 52.59 Favored 'General case' 0 C--N 1.353 0.725 0 C-N-CA 124.644 1.178 . . . . 0.0 110.917 -176.693 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.528 ' HB3' HG23 ' A' ' 8' ' ' VAL . 75.3 mt -64.9 -29.23 70.16 Favored 'General case' 0 N--CA 1.48 1.061 0 CA-C-N 115.665 -0.698 . . . . 0.0 112.196 -178.493 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.513 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 31.7 mt -70.63 -55.84 12.91 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.569 0 N-CA-C 108.619 -0.882 . . . . 0.0 108.619 177.137 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 -63.23 -55.83 21.65 Favored 'General case' 0 N--CA 1.472 0.649 0 CA-C-N 114.43 -1.259 . . . . 0.0 111.474 -170.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.49 -40.74 79.28 Favored 'General case' 0 N--CA 1.481 1.109 0 O-C-N 124.082 0.863 . . . . 0.0 111.611 -175.823 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.4 ' HE2' ' HB2' ' A' ' 11' ' ' ARG . 58.0 t80 -63.98 -39.03 93.2 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 124.463 1.105 . . . . 0.0 111.727 177.239 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.513 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 89.7 mt -67.76 -38.11 83.01 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 122.535 0.334 . . . . 0.0 110.281 178.394 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 56.4 m-80 -70.04 -28.33 65.37 Favored 'General case' 0 N--CA 1.488 1.434 0 C-N-CA 123.361 0.664 . . . . 0.0 111.195 175.432 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 54.8 m -64.87 -24.32 67.5 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 123.243 0.617 . . . . 0.0 111.451 176.737 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 38.1 mt-30 -104.61 -4.49 22.48 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 124.076 0.95 . . . . 0.0 111.081 -179.125 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 35.4 ttpt . . . . . 0 C--O 1.25 1.089 0 C-N-CA 123.95 0.9 . . . . 0.0 109.032 -175.255 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.196 0 CA-C-O 121.145 0.497 . . . . 0.0 110.49 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 4.5 mmp_? -120.0 129.74 54.41 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.958 0.903 . . . . 0.0 110.355 -176.158 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 8.7 t -95.29 135.31 37.05 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.806 0.843 . . . . 0.0 111.032 -178.621 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 37.8 mtmm -93.33 71.56 4.45 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.526 0.679 . . . . 0.0 110.028 176.1 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 13.0 mt-30 -71.38 135.11 47.14 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 115.073 -0.967 . . . . 0.0 109.891 175.417 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 19.2 m -111.02 150.14 29.73 Favored 'General case' 0 C--O 1.242 0.675 0 CA-C-O 121.49 0.662 . . . . 0.0 111.151 -165.652 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.82 172.49 18.39 Favored 'General case' 0 C--O 1.248 1.002 0 C-N-CA 124.934 1.293 . . . . 0.0 109.381 175.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.526 ' HG2' ' HA2' ' A' ' 1' ' ' GLY . 0.0 OUTLIER -119.29 146.02 45.62 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 107.951 -1.129 . . . . 0.0 107.951 177.38 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.474 ' N ' ' HD3' ' B' ' 8' ' ' ARG . . . . . . . . 0 N--CA 1.471 0.614 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 169.899 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 32.4 t -62.49 122.67 16.33 Favored 'General case' 0 C--O 1.24 0.561 0 O-C-N 123.84 0.712 . . . . 0.0 109.286 -179.246 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 39.8 p -60.04 -20.27 57.08 Favored 'General case' 0 CA--C 1.555 1.135 0 C-N-CA 124.335 1.054 . . . . 0.0 112.736 -176.354 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 175.35 -121.94 0.85 Allowed Glycine 0 C--N 1.342 0.894 0 N-CA-C 110.534 -1.026 . . . . 0.0 110.534 173.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -152.13 150.6 22.48 Favored Glycine 0 C--N 1.336 0.557 0 N-CA-C 110.953 -0.859 . . . . 0.0 110.953 179.74 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -145.51 129.68 17.59 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.754 0.822 . . . . 0.0 109.183 -177.611 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.141 0 C-N-CA 124.121 0.968 . . . . 0.0 109.457 -176.485 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.477 1.433 0 N-CA-C 113.281 0.073 . . . . 0.0 113.281 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 28.4 mm-40 -96.23 -55.1 3.06 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 122.968 0.507 . . . . 0.0 110.55 -179.921 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 90.7 m-85 -130.86 146.24 52.24 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.515 0.726 . . . . 0.0 110.0 -175.49 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.475 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 11.1 m -66.75 134.0 30.62 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.578 0 CA-C-N 115.662 -0.699 . . . . 0.0 111.019 176.768 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.458 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -101.97 131.65 49.52 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.568 0.747 . . . . 0.0 109.351 173.715 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -70.37 -56.28 7.05 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.379 0.671 . . . . 0.0 110.585 -178.854 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.481 ' HA ' HD22 ' A' ' 45' ' ' LEU . 0.1 OUTLIER -159.3 163.07 36.05 Favored 'General case' 0 N--CA 1.476 0.829 0 CA-C-O 121.121 0.486 . . . . 0.0 111.673 -177.234 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.416 HG23 ' HB3' ' A' ' 45' ' ' LEU . 72.2 t -82.04 129.19 37.89 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.557 0 CA-C-N 114.611 -1.177 . . . . 0.0 109.586 171.603 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 53.3 mt -86.67 -54.5 4.35 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 124.199 1.0 . . . . 0.0 110.176 178.595 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.0 t0 -151.9 164.51 36.95 Favored 'General case' 0 N--CA 1.473 0.699 0 CA-C-N 115.118 -0.947 . . . . 0.0 109.27 -172.96 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 28.5 ttt180 -131.17 141.22 50.06 Favored 'General case' 0 N--CA 1.47 0.569 0 C-N-CA 124.392 1.077 . . . . 0.0 109.297 176.88 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 5.6 ptp180 -136.45 171.05 15.06 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.786 0.834 . . . . 0.0 109.561 173.717 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.404 ' HA ' ' O ' ' A' ' 17' ' ' LYS . 90.4 t -124.1 115.2 44.18 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.763 0 C-N-CA 124.205 1.002 . . . . 0.0 108.95 174.009 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.421 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 92.4 t -126.31 127.97 71.1 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.183 0 N-CA-C 108.489 -0.93 . . . . 0.0 108.489 176.161 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 66.7 t30 66.08 15.86 10.24 Favored 'General case' 0 N--CA 1.487 1.389 0 C-N-CA 124.2 1.0 . . . . 0.0 111.031 -179.859 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 82.54 14.57 75.74 Favored Glycine 0 C--N 1.35 1.33 0 CA-C-N 116.03 -0.532 . . . . 0.0 113.651 -176.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.421 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 14.5 ptmt -108.92 157.25 18.8 Favored 'General case' 0 N--CA 1.479 0.975 0 N-CA-C 108.794 -0.817 . . . . 0.0 108.794 175.017 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 62.4 t -96.67 125.24 49.67 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.592 0 C-N-CA 123.554 0.741 . . . . 0.0 109.742 177.464 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.463 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 47.1 mt-10 -120.93 135.98 55.06 Favored 'General case' 0 N--CA 1.474 0.733 0 C-N-CA 123.389 0.676 . . . . 0.0 109.997 174.336 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.414 ' HE2' ' HB3' ' A' ' 37' ' ' GLU . 96.3 m-85 -109.79 129.47 55.62 Favored 'General case' 0 CA--C 1.539 0.551 0 C-N-CA 124.447 1.099 . . . . 0.0 109.893 177.693 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 2.3 t80 -76.23 107.95 8.82 Favored 'General case' 0 N--CA 1.469 0.497 0 N-CA-C 107.482 -1.303 . . . . 0.0 107.482 174.985 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.4 HD22 HG21 ' A' ' 5' ' ' VAL . 18.3 mt -102.66 127.44 49.77 Favored 'General case' 0 C--N 1.329 -0.312 0 C-N-CA 122.876 0.47 . . . . 0.0 111.347 -172.314 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 8.3 tmtt? -96.01 121.28 37.59 Favored 'General case' 0 CA--C 1.539 0.543 0 N-CA-C 107.185 -1.413 . . . . 0.0 107.185 171.58 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.458 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 66.4 m95 -82.2 137.77 34.84 Favored 'General case' 0 C--O 1.241 0.606 0 C-N-CA 123.147 0.579 . . . . 0.0 111.27 -173.025 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.411 ' HB3' HG23 ' A' ' 4' ' ' VAL . 37.7 ttpt -76.6 132.28 39.36 Favored 'General case' 0 C--N 1.349 0.571 0 C-N-CA 123.665 0.786 . . . . 0.0 110.576 -173.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 83.78 -0.24 89.58 Favored Glycine 0 C--N 1.35 1.342 0 O-C-N 123.689 0.618 . . . . 0.0 113.834 178.655 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 79.7 m-85 -104.86 173.36 6.33 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.324 1.05 . . . . 0.0 110.966 -179.314 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 67.1 p -65.44 162.05 18.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 123.791 0.836 . . . . 0.0 112.015 -179.363 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 22.7 t70 -62.81 -41.6 99.36 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 123.532 0.733 . . . . 0.0 111.248 -176.894 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.63 -16.59 63.41 Favored 'General case' 0 CA--C 1.548 0.899 0 CA-C-N 115.425 -0.807 . . . . 0.0 112.256 178.782 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 15.7 t70 -81.24 77.73 8.1 Favored 'General case' 0 CA--C 1.545 0.755 0 C-N-CA 124.139 0.976 . . . . 0.0 109.168 -178.257 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 10.3 p30 -143.02 131.51 22.33 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 113.987 -1.461 . . . . 0.0 109.794 175.242 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 55.3 p -131.74 147.42 52.5 Favored 'General case' 0 N--CA 1.486 1.354 0 C-N-CA 123.957 0.903 . . . . 0.0 110.465 -173.809 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 94.7 m95 -76.49 109.53 10.3 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 122.88 0.472 . . . . 0.0 110.041 176.36 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 75.0 mm-40 -114.12 129.69 24.59 Favored Pre-proline 0 CA--C 1.543 0.68 0 C-N-CA 124.403 1.081 . . . . 0.0 110.458 -179.696 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.463 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 72.7 Cg_endo -72.29 150.81 53.56 Favored 'Trans proline' 0 C--N 1.37 1.672 0 C-N-CA 122.442 2.095 . . . . 0.0 111.985 175.799 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.514 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.06 -26.69 64.84 Favored 'General case' 0 N--CA 1.489 1.521 0 C-N-CA 124.319 1.048 . . . . 0.0 113.09 -176.671 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -65.85 -31.56 72.58 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.658 0.783 . . . . 0.0 111.215 179.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -91.44 -14.23 30.9 Favored 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.033 0.933 . . . . 0.0 110.555 -173.123 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.514 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 10.0 mt -79.07 141.01 37.74 Favored 'General case' 0 N--CA 1.473 0.68 0 C-N-CA 122.786 0.434 . . . . 0.0 110.096 -177.842 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 1.8 m-20 -97.06 0.2 48.24 Favored 'General case' 0 N--CA 1.47 0.568 0 N-CA-C 109.469 -0.567 . . . . 0.0 109.469 173.247 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.513 ' HA ' ' HG2' ' B' ' 5' ' ' GLN . 33.5 t -111.02 96.98 32.55 Favored Pre-proline 0 C--N 1.356 0.848 0 C-N-CA 123.661 0.785 . . . . 0.0 111.453 -173.997 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 89.5 Cg_endo -78.85 -17.15 12.41 Favored 'Trans proline' 0 C--N 1.375 1.953 0 C-N-CA 122.665 2.243 . . . . 0.0 111.578 169.956 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 34.9 tt0 -71.13 -43.94 66.59 Favored 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.024 0.929 . . . . 0.0 110.737 -176.606 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 7' ' ' LYS . 21.2 mt -68.35 -40.18 81.61 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.124 0.569 . . . . 0.0 111.55 177.092 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.528 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 66.6 mt -58.62 -52.15 63.25 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 O-C-N 123.814 0.696 . . . . 0.0 109.781 175.779 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.7 tt0 -59.9 -52.66 64.47 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.568 0.747 . . . . 0.0 111.298 179.998 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.72 -36.32 71.86 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.856 0.862 . . . . 0.0 111.598 -176.73 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 71.3 t80 -68.7 -45.3 71.96 Favored 'General case' 0 CA--C 1.547 0.829 0 CA-C-N 114.974 -1.012 . . . . 0.0 111.129 177.076 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.528 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 79.9 mt -64.85 -35.97 82.85 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 123.143 0.577 . . . . 0.0 110.403 179.154 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.04 -29.09 61.73 Favored 'General case' 0 N--CA 1.479 1.0 0 C-N-CA 124.101 0.96 . . . . 0.0 110.299 178.937 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 24.8 t -75.61 -18.74 59.61 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 123.43 0.692 . . . . 0.0 110.626 177.306 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 74.1 mt-30 -73.38 -33.34 64.98 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 123.081 0.552 . . . . 0.0 110.055 171.057 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 72.8 mmtt . . . . . 0 C--O 1.252 1.234 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.321 -179.364 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.95 0 N-CA-C 110.179 -0.304 . . . . 0.0 110.179 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 16.1 ptp180 -74.38 -22.64 59.09 Favored 'General case' 0 N--CA 1.475 0.823 0 CA-C-N 115.76 -0.654 . . . . 0.0 109.981 168.4 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 81.6 p -75.55 145.76 41.0 Favored 'General case' 0 C--O 1.239 0.51 0 C-N-CA 124.16 0.984 . . . . 0.0 111.841 -172.187 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 60.8 pttt -121.85 -6.45 9.05 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 114.655 -1.157 . . . . 0.0 109.903 176.393 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.513 ' HG2' ' HA ' ' A' ' 42' ' ' CYS . 4.6 tp-100 -75.8 154.93 35.9 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 123.231 0.613 . . . . 0.0 111.457 -166.869 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.475 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 2.0 m -107.02 171.88 7.13 Favored 'General case' 0 CA--C 1.561 1.374 0 C-N-CA 124.021 0.928 . . . . 0.0 110.729 -166.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -157.8 144.46 17.85 Favored 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.751 0.82 . . . . 0.0 109.423 171.473 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -88.66 144.38 26.33 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 122.977 0.511 . . . . 0.0 109.995 177.127 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.695 0 C-N-CA 123.465 0.706 . . . . 0.0 109.932 176.639 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 49.5 m -74.36 87.25 2.02 Favored 'General case' 0 CA--C 1.539 0.531 0 C-N-CA 123.23 0.612 . . . . 0.0 109.42 -179.858 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 37.0 m -123.91 104.75 9.11 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.772 0.829 . . . . 0.0 109.362 -178.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -175.68 -49.5 0.06 OUTLIER Glycine 0 C--N 1.343 0.961 0 N-CA-C 111.442 -0.663 . . . . 0.0 111.442 178.439 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 68.54 -91.07 0.25 Allowed Glycine 0 C--N 1.349 1.268 0 O-C-N 124.128 0.546 . . . . 0.0 112.582 -179.899 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -80.39 156.17 26.8 Favored 'General case' 0 C--O 1.24 0.594 0 C-N-CA 123.45 0.7 . . . . 0.0 110.478 175.068 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.194 0 C-N-CA 124.202 1.001 . . . . 0.0 108.665 175.544 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.676 0 N-CA-C 112.813 -0.115 . . . . 0.0 112.813 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.6 mm-40 -101.06 -31.75 10.93 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 123.116 0.566 . . . . 0.0 111.614 -174.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 69.8 m-85 -129.88 137.94 50.68 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.247 0.619 . . . . 0.0 110.216 -173.988 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.6 p -80.66 110.81 16.6 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.619 0 CA-C-O 121.825 0.821 . . . . 0.0 110.388 178.815 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.416 HG21 HD22 ' A' ' 22' ' ' LEU . 1.4 p -81.6 131.39 33.95 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.761 0 CA-C-N 115.069 -0.969 . . . . 0.0 108.733 168.353 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.505 ' HB2' ' HB2' ' A' ' 25' ' ' LYS . 39.1 tt0 -74.94 -49.49 19.97 Favored 'General case' 0 N--CA 1.47 0.528 0 C-N-CA 123.421 0.688 . . . . 0.0 110.416 174.427 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -161.89 162.42 29.22 Favored 'General case' 0 N--CA 1.47 0.561 0 CA-C-O 121.318 0.58 . . . . 0.0 111.015 -172.825 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.488 HG11 ' HD2' ' A' ' 20' ' ' TYR . 61.1 t -89.99 141.27 14.58 Favored 'Isoleucine or valine' 0 C--O 1.238 0.467 0 CA-C-N 115.022 -0.99 . . . . 0.0 108.363 172.145 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 76.3 mt -105.42 -47.6 3.9 Favored 'General case' 0 C--O 1.237 0.409 0 C-N-CA 123.96 0.904 . . . . 0.0 109.918 -177.127 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.7 t70 -144.62 164.47 30.85 Favored 'General case' 0 N--CA 1.477 0.89 0 N-CA-C 109.525 -0.546 . . . . 0.0 109.525 -175.0 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 55.6 ttt180 -138.75 126.5 22.16 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.324 1.05 . . . . 0.0 109.509 -175.595 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.6 ptm180 -126.83 164.17 21.98 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.761 0.824 . . . . 0.0 109.856 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 96.8 t -125.61 116.79 47.48 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.811 0 N-CA-C 108.553 -0.906 . . . . 0.0 108.553 173.042 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 87.2 t -123.62 118.9 55.71 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.088 0.955 . . . . 0.0 109.559 179.262 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 81.3 m-20 62.34 32.6 16.88 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.811 1.245 . . . . 0.0 111.784 175.493 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.2 -26.81 11.8 Favored Glycine 0 N--CA 1.472 1.046 0 CA-C-N 115.729 -0.669 . . . . 0.0 113.301 -177.478 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.3 ttpp -79.44 152.74 30.14 Favored 'General case' 0 C--N 1.348 0.511 0 C-N-CA 123.995 0.918 . . . . 0.0 109.48 -177.811 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 47.9 t -114.34 113.69 44.51 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 N-CA-C 109.064 -0.717 . . . . 0.0 109.064 -175.923 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.546 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 49.7 mt-10 -106.49 153.47 22.25 Favored 'General case' 0 N--CA 1.473 0.713 0 C-N-CA 123.971 0.908 . . . . 0.0 110.536 -179.92 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.488 ' HD2' HG11 ' A' ' 8' ' ' VAL . 92.6 m-85 -132.01 126.88 35.02 Favored 'General case' 0 CA--C 1.539 0.546 0 C-N-CA 124.296 1.038 . . . . 0.0 108.95 -176.733 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 31.3 t80 -77.55 107.47 10.03 Favored 'General case' 0 N--CA 1.474 0.732 0 N-CA-C 107.979 -1.119 . . . . 0.0 107.979 178.13 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.416 HD22 HG21 ' A' ' 5' ' ' VAL . 42.3 mt -96.71 123.34 40.37 Favored 'General case' 0 N--CA 1.465 0.315 0 C-N-CA 123.112 0.565 . . . . 0.0 111.734 -168.987 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 41.6 tptt -73.83 106.05 5.38 Favored 'General case' 0 C--N 1.344 0.347 0 N-CA-C 108.524 -0.917 . . . . 0.0 108.524 165.474 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.496 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 76.4 m95 -78.93 116.92 19.55 Favored 'General case' 0 CA--C 1.537 0.457 0 N-CA-C 108.721 -0.844 . . . . 0.0 108.721 173.851 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.505 ' HB2' ' HB2' ' A' ' 6' ' ' GLU . 38.7 ttpt -61.9 -41.05 97.43 Favored 'General case' 0 CA--C 1.545 0.764 0 C-N-CA 123.756 0.823 . . . . 0.0 112.338 -170.449 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -84.62 5.83 79.99 Favored Glycine 0 CA--C 1.534 1.274 0 N-CA-C 114.226 0.45 . . . . 0.0 114.226 -176.901 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 94.4 m-85 -132.09 170.73 14.56 Favored 'General case' 0 N--CA 1.485 1.323 0 C-N-CA 123.691 0.796 . . . . 0.0 111.407 -173.867 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 77.5 p -72.83 160.99 31.29 Favored 'General case' 0 CA--C 1.547 0.832 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.533 178.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 35.8 m-20 -72.9 -29.56 63.24 Favored 'General case' 0 N--CA 1.469 0.513 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.342 -177.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -69.44 -22.43 63.66 Favored 'General case' 0 N--CA 1.479 0.98 0 C-N-CA 122.991 0.516 . . . . 0.0 111.351 174.926 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 20.0 t70 -92.29 -1.13 57.28 Favored 'General case' 0 CA--C 1.55 0.963 0 C-N-CA 123.541 0.737 . . . . 0.0 111.164 -178.506 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.496 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 84.4 m-20 -64.89 139.49 58.77 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 122.978 0.511 . . . . 0.0 110.666 173.372 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 39.5 p -131.57 155.77 46.92 Favored 'General case' 0 N--CA 1.489 1.511 0 C-N-CA 123.185 0.594 . . . . 0.0 112.116 -170.894 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 99.1 m95 -77.3 113.48 15.12 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.532 0.733 . . . . 0.0 109.444 171.978 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.6 mm-40 -121.9 129.56 25.1 Favored Pre-proline 0 CA--C 1.537 0.466 0 C-N-CA 122.913 0.485 . . . . 0.0 110.379 176.647 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.546 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 73.4 Cg_endo -71.75 149.89 55.23 Favored 'Trans proline' 0 C--N 1.374 1.895 0 C-N-CA 122.737 2.291 . . . . 0.0 112.18 178.782 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.445 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 9.5 pt-20 -60.28 -24.0 64.58 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 123.867 0.867 . . . . 0.0 112.741 -175.405 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.51 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 9.3 pt-20 -65.81 -35.36 80.48 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 123.902 0.881 . . . . 0.0 111.307 175.773 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 63.2 t30 -82.42 -21.94 35.53 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 124.386 1.074 . . . . 0.0 110.687 -175.191 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.532 HD22 ' HB1' ' B' ' 7' ' ' ALA . 7.6 mt -86.14 142.14 28.87 Favored 'General case' 0 N--CA 1.471 0.605 0 N-CA-C 109.091 -0.707 . . . . 0.0 109.091 -179.223 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -108.75 26.13 10.93 Favored 'General case' 0 N--CA 1.486 1.338 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 173.382 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.479 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 47.0 t -117.28 90.85 35.4 Favored Pre-proline 0 C--N 1.346 0.451 0 CA-C-N 114.692 -1.14 . . . . 0.0 110.902 -176.408 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 13.8 Cg_exo -70.96 -22.16 26.93 Favored 'Trans proline' 0 C--N 1.368 1.57 0 C-N-CA 122.507 2.138 . . . . 0.0 111.013 170.202 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 11.6 tp10 -56.86 -60.18 3.95 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 124.118 0.967 . . . . 0.0 111.445 -179.378 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.44 ' HG ' ' SG ' ' A' ' 42' ' ' CYS . 89.6 mt -78.22 -29.73 48.45 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 122.802 0.441 . . . . 0.0 112.027 -172.031 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.465 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 93.0 mt -63.68 -56.08 18.93 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 N-CA-C 109.734 -0.469 . . . . 0.0 109.734 175.293 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -71.34 -41.56 69.66 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 115.575 -0.739 . . . . 0.0 111.594 -174.385 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.83 -34.23 77.68 Favored 'General case' 0 N--CA 1.484 1.238 0 O-C-N 123.046 0.216 . . . . 0.0 111.148 -177.871 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -60.42 -44.21 95.98 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 123.606 0.762 . . . . 0.0 110.799 173.205 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.465 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 69.4 mt -66.92 -39.02 87.24 Favored 'General case' 0 CA--C 1.544 0.725 0 CA-C-N 115.86 -0.609 . . . . 0.0 109.781 178.019 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.2 m-20 -71.61 -21.77 61.8 Favored 'General case' 0 N--CA 1.483 1.175 0 C-N-CA 123.904 0.882 . . . . 0.0 111.42 -179.576 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 49.1 m -72.23 -31.19 65.61 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 123.064 0.545 . . . . 0.0 110.226 173.702 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 65.9 mt-30 -77.01 -32.77 57.38 Favored 'General case' 0 N--CA 1.472 0.644 0 C-N-CA 123.332 0.653 . . . . 0.0 110.559 179.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 1.6 mmmp? . . . . . 0 C--O 1.25 1.088 0 C-N-CA 123.622 0.769 . . . . 0.0 109.475 -176.32 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 109.937 -0.394 . . . . 0.0 109.937 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 39.9 ptt180 -84.59 -1.72 56.38 Favored 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.74 0.816 . . . . 0.0 111.028 175.933 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 13.6 p -65.16 97.32 0.25 Allowed 'General case' 0 C--O 1.244 0.796 0 C-N-CA 123.596 0.758 . . . . 0.0 110.994 174.359 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.438 ' HD3' ' HA ' ' A' ' 6' ' ' GLU . 26.6 mtpp -68.86 145.91 53.3 Favored 'General case' 0 C--O 1.244 0.764 0 N-CA-C 108.083 -1.08 . . . . 0.0 108.083 168.392 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.479 ' HB3' ' SG ' ' A' ' 42' ' ' CYS . 20.5 tp60 -56.84 123.02 13.59 Favored 'General case' 0 CA--C 1.545 0.756 0 O-C-N 123.717 0.635 . . . . 0.0 110.029 -172.491 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 9.0 t -86.75 173.98 9.12 Favored 'General case' 0 C--O 1.252 1.214 0 C-N-CA 124.106 0.963 . . . . 0.0 113.075 -160.419 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . 0.532 ' HB1' HD22 ' A' ' 40' ' ' LEU . . . -147.78 155.06 41.28 Favored 'General case' 0 C--O 1.243 0.735 0 CA-C-N 114.471 -1.24 . . . . 0.0 110.088 -179.183 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 2.6 ttm180 -97.11 164.93 12.3 Favored 'General case' 0 CA--C 1.548 0.896 0 N-CA-C 108.872 -0.788 . . . . 0.0 108.872 177.158 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.407 HM33 ' CD1' ' A' ' 24' ' ' TRP . . . . . . . . 0 N--CA 1.474 0.751 0 CA-C-O 121.301 0.572 . . . . 0.0 109.837 168.831 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 13.3 p -75.9 95.11 3.46 Favored 'General case' 0 CA--C 1.54 0.568 0 CA-C-N 114.809 -1.087 . . . . 0.0 110.116 -177.48 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 5.1 t -142.24 136.4 29.82 Favored 'General case' 0 C--O 1.243 0.715 0 C-N-CA 124.181 0.993 . . . . 0.0 108.941 179.061 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -167.13 -64.52 0.03 OUTLIER Glycine 0 C--N 1.34 0.784 0 N-CA-C 111.587 -0.605 . . . . 0.0 111.587 -178.097 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 169.7 120.21 0.52 Allowed Glycine 0 C--N 1.346 1.107 0 N-CA-C 111.633 -0.587 . . . . 0.0 111.633 -179.516 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 98.9 mttt -99.99 135.85 40.79 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.682 0.793 . . . . 0.0 109.811 176.233 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.254 1.34 0 C-N-CA 123.015 0.526 . . . . 0.0 109.764 179.944 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.418 ' HA3' ' HB3' ' B' ' 9' ' ' M3L . . . . . . . . 0 N--CA 1.486 2.008 0 N-CA-C 111.799 -0.52 . . . . 0.0 111.799 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.707 ' HG3' ' HG2' ' B' ' 8' ' ' ARG . 7.1 mp0 -81.49 121.14 25.91 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.804 0.842 . . . . 0.0 109.591 -169.74 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.453 ' HE2' ' H ' ' A' ' 26' ' ' GLY . 47.1 t80 -139.6 154.1 47.51 Favored 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 123.456 0.702 . . . . 0.0 109.635 179.156 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 65.5 t -77.68 116.87 21.85 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.756 0 C-N-CA 123.086 0.555 . . . . 0.0 110.926 179.907 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.455 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 3.2 p -92.55 142.0 13.78 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.793 0 C-N-CA 123.863 0.865 . . . . 0.0 110.66 175.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 11.8 tp10 -79.64 -57.85 3.47 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.173 0.989 . . . . 0.0 110.848 176.352 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -160.81 169.39 22.8 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 122.794 0.438 . . . . 0.0 111.866 -175.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.441 HG13 ' HB3' ' A' ' 20' ' ' TYR . 43.9 t -92.17 141.45 14.55 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.751 0 C-N-CA 124.061 0.944 . . . . 0.0 109.194 171.057 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 74.1 mt -111.43 -35.4 5.83 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.508 1.123 . . . . 0.0 110.786 -177.514 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.8 t0 -157.26 164.62 37.49 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.434 0.694 . . . . 0.0 109.812 -173.299 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 64.0 ttt-85 -132.7 154.02 50.56 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.985 0.914 . . . . 0.0 109.971 -179.405 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.1 ptm180 -146.24 161.47 40.21 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.956 0.902 . . . . 0.0 109.28 174.788 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.1 t -116.87 124.19 72.63 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 N-CA-C 108.26 -1.015 . . . . 0.0 108.26 169.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.425 HG12 HD22 ' A' ' 15' ' ' ASN . 47.0 t -112.49 108.83 26.52 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.667 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 176.384 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . 0.425 HD22 HG12 ' A' ' 14' ' ' VAL . 36.6 m-80 64.97 -73.58 0.06 Allowed 'General case' 0 N--CA 1.49 1.575 0 C-N-CA 125.153 1.381 . . . . 0.0 111.033 -172.961 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -147.72 -9.34 0.2 Allowed Glycine 0 CA--C 1.528 0.852 0 CA-C-N 115.741 -0.663 . . . . 0.0 112.607 176.136 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.445 ' HE2' ' HB3' ' A' ' 36' ' ' PRO . 15.6 ptmt -81.28 170.47 16.02 Favored 'General case' 0 N--CA 1.477 0.917 0 N-CA-C 109.192 -0.669 . . . . 0.0 109.192 178.543 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 99.1 t -124.51 127.82 73.2 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.662 0 C-N-CA 123.139 0.576 . . . . 0.0 109.497 176.899 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -118.33 139.52 51.22 Favored 'General case' 0 N--CA 1.472 0.663 0 N-CA-C 109.626 -0.509 . . . . 0.0 109.626 173.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.441 ' HB3' HG13 ' A' ' 8' ' ' VAL . 98.0 m-85 -111.28 132.66 54.2 Favored 'General case' 0 CA--C 1.539 0.542 0 C-N-CA 124.293 1.037 . . . . 0.0 109.641 -178.739 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 35.0 t80 -78.42 108.56 11.86 Favored 'General case' 0 N--CA 1.468 0.438 0 N-CA-C 108.357 -0.979 . . . . 0.0 108.357 177.157 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 51.8 mt -101.41 123.04 44.84 Favored 'General case' 0 C--O 1.235 0.329 0 C-N-CA 123.34 0.656 . . . . 0.0 112.169 -168.065 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.7 tmtp? -78.07 110.13 12.76 Favored 'General case' 0 N--CA 1.453 -0.292 0 N-CA-C 106.878 -1.527 . . . . 0.0 106.878 165.737 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.559 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 71.9 m95 -80.7 148.95 29.94 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 122.862 0.465 . . . . 0.0 110.342 178.975 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.607 ' HD3' ' HD3' ' B' ' 4' ' ' LYS . 33.2 ttpt -58.52 -48.44 80.84 Favored 'General case' 0 CA--C 1.547 0.851 0 O-C-N 123.67 0.606 . . . . 0.0 110.94 178.835 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . 0.453 ' H ' ' HE2' ' A' ' 3' ' ' PHE . . . -103.76 15.3 52.61 Favored Glycine 0 C--N 1.34 0.805 0 CA-C-N 115.584 -0.735 . . . . 0.0 114.207 -173.374 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.559 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 55.5 m-85 -132.83 136.64 46.38 Favored 'General case' 0 N--CA 1.48 1.03 0 CA-C-N 117.605 0.702 . . . . 0.0 109.925 175.267 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 29.5 p -80.71 -179.22 7.14 Favored 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 124.292 1.037 . . . . 0.0 111.835 -175.662 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 33.1 t70 -49.83 -51.45 39.83 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 125.135 1.374 . . . . 0.0 113.582 -170.313 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.12 -20.84 62.28 Favored 'General case' 0 N--CA 1.477 0.919 0 N-CA-C 112.735 0.643 . . . . 0.0 112.735 -174.25 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.421 ' HB3' ' HB3' ' A' ' 27' ' ' PHE . 11.1 t70 -91.25 -17.85 25.33 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 122.833 0.453 . . . . 0.0 111.209 -178.29 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -58.17 136.99 57.36 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.479 0.712 . . . . 0.0 111.672 -177.93 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . 0.538 HG21 HM12 ' B' ' 9' ' ' M3L . 33.8 p -128.41 156.79 42.6 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.372 0.669 . . . . 0.0 112.669 -166.758 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 98.4 m95 -80.32 117.53 21.16 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 124.095 0.958 . . . . 0.0 110.369 173.618 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -118.66 135.52 23.72 Favored Pre-proline 0 N--CA 1.475 0.824 0 C-N-CA 123.006 0.523 . . . . 0.0 110.311 175.3 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.509 ' HB2' ' HG2' ' A' ' 38' ' ' GLU . 94.9 Cg_endo -74.55 150.94 41.29 Favored 'Trans proline' 0 C--N 1.365 1.425 0 C-N-CA 122.463 2.109 . . . . 0.0 112.511 179.781 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -58.37 -27.69 64.46 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.032 0.933 . . . . 0.0 112.572 179.68 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.509 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 15.7 pt-20 -60.7 -35.75 77.08 Favored 'General case' 0 CA--C 1.552 1.034 0 C-N-CA 123.199 0.6 . . . . 0.0 110.94 177.326 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 5.1 m-20 -83.51 -34.78 25.24 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.788 0.835 . . . . 0.0 111.149 -179.904 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.528 HD12 HD11 ' A' ' 46' ' ' ILE . 19.2 mt -62.78 136.75 58.03 Favored 'General case' 0 N--CA 1.48 1.06 0 N-CA-C 112.248 0.462 . . . . 0.0 112.248 -170.172 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 22.9 t70 -108.57 29.52 7.33 Favored 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.174 -1.047 . . . . 0.0 108.174 171.731 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.473 ' SG ' ' HB3' ' B' ' 5' ' ' GLN . 19.7 m -116.27 89.51 26.39 Favored Pre-proline 0 CA--C 1.543 0.686 0 CA-C-N 115.466 -0.788 . . . . 0.0 110.262 -175.072 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 74.5 Cg_endo -77.97 -26.48 6.58 Favored 'Trans proline' 0 C--N 1.373 1.839 0 C-N-CA 121.742 1.628 . . . . 0.0 111.097 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.9 tp10 -65.51 -56.14 13.99 Favored 'General case' 0 C--N 1.35 0.601 0 C-N-CA 124.328 1.051 . . . . 0.0 111.127 -179.408 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.541 ' HG ' ' HG3' ' B' ' 5' ' ' GLN . 83.9 mt -65.95 -40.26 91.17 Favored 'General case' 0 N--CA 1.478 0.964 0 O-C-N 123.677 0.61 . . . . 0.0 111.638 -174.012 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.528 HD11 HD12 ' A' ' 40' ' ' LEU . 76.5 mt -66.36 -47.94 82.49 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 O-C-N 123.472 0.483 . . . . 0.0 110.54 179.743 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -58.34 -50.85 72.16 Favored 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 123.317 0.647 . . . . 0.0 110.794 179.075 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.78 -37.25 85.92 Favored 'General case' 0 N--CA 1.473 0.687 0 CA-C-N 114.84 -1.073 . . . . 0.0 111.534 -178.652 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 49.5 t80 -64.2 -49.75 70.79 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.132 0.973 . . . . 0.0 110.805 178.564 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.405 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 80.0 mt -66.24 -38.61 88.3 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.986 -0.552 . . . . 0.0 110.904 -177.728 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -78.16 -18.32 55.71 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.657 0.783 . . . . 0.0 111.883 178.983 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 32.8 t -76.56 -28.66 56.34 Favored 'General case' 0 N--CA 1.48 1.036 0 CA-C-O 120.898 0.38 . . . . 0.0 110.016 174.162 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.4 HE21 ' HA ' ' A' ' 50' ' ' LEU . 45.3 mt-30 -83.02 -37.56 23.77 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.707 0.803 . . . . 0.0 110.327 177.709 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 48.8 mmtm . . . . . 0 CA--C 1.547 0.848 0 CA-C-N 115.899 -0.591 . . . . 0.0 109.892 179.717 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.391 0 N-CA-C 110.307 -0.257 . . . . 0.0 110.307 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -75.43 -19.85 59.24 Favored 'General case' 0 N--CA 1.489 1.482 0 C-N-CA 122.66 0.384 . . . . 0.0 110.094 172.629 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 24.7 m -63.48 83.56 0.03 OUTLIER 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 124.131 0.972 . . . . 0.0 109.66 175.4 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.607 ' HD3' ' HD3' ' A' ' 25' ' ' LYS . 0.0 OUTLIER -144.62 114.29 7.21 Favored 'General case' 0 N--CA 1.47 0.558 0 C-N-CA 124.66 1.184 . . . . 0.0 109.073 -172.35 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.541 ' HG3' ' HG ' ' A' ' 45' ' ' LEU . 87.4 mm-40 -94.24 156.3 16.61 Favored 'General case' 0 N--CA 1.469 0.486 0 C-N-CA 123.281 0.632 . . . . 0.0 110.556 -178.275 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 37.4 m -110.63 137.35 48.43 Favored 'General case' 0 CA--C 1.539 0.548 0 C-N-CA 123.534 0.733 . . . . 0.0 109.24 179.41 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -129.1 145.47 51.28 Favored 'General case' 0 C--O 1.235 0.327 0 C-N-CA 123.866 0.866 . . . . 0.0 108.988 176.604 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.707 ' HG2' ' HG3' ' A' ' 2' ' ' GLU . 67.2 mtt85 -105.6 139.93 39.45 Favored 'General case' 0 C--N 1.328 -0.347 0 CA-C-N 115.701 -0.681 . . . . 0.0 109.852 -172.585 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.538 HM12 HG21 ' A' ' 33' ' ' THR . . . . . . . . 0 C--O 1.244 0.764 0 C-N-CA 123.34 0.656 . . . . 0.0 109.271 173.571 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 22.3 t -65.85 168.3 8.18 Favored 'General case' 0 CA--C 1.551 1.004 0 C-N-CA 123.603 0.761 . . . . 0.0 111.168 174.587 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 75.4 p 50.81 75.85 0.17 Allowed 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.89 1.276 . . . . 0.0 110.917 -173.356 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 144.32 -101.04 0.24 Allowed Glycine 0 C--N 1.342 0.898 0 CA-C-N 114.747 -1.115 . . . . 0.0 110.539 -174.034 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 68.97 11.42 63.35 Favored Glycine 0 C--N 1.348 1.218 0 O-C-N 123.688 0.287 . . . . 0.0 113.562 -178.361 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.32 118.3 9.4 Favored 'General case' 0 N--CA 1.474 0.752 0 C-N-CA 124.367 1.067 . . . . 0.0 109.278 -175.572 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . 0.442 ' HB2' ' HG2' ' A' ' 2' ' ' GLU . . . . . . . . 0 C--O 1.251 1.182 0 C-N-CA 123.74 0.816 . . . . 0.0 108.966 176.05 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.803 0 N-CA-C 112.299 -0.321 . . . . 0.0 112.299 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.5 tt0 -76.77 164.34 25.95 Favored 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.241 0.616 . . . . 0.0 109.508 178.712 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 71.5 m-85 -81.72 114.91 20.7 Favored 'General case' 0 C--N 1.349 0.554 0 N-CA-C 109.752 -0.462 . . . . 0.0 109.752 -169.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.513 HG22 HG22 ' B' ' 6' ' ' THR . 47.0 t -84.35 132.08 32.42 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.25 0 N-CA-C 108.536 -0.913 . . . . 0.0 108.536 176.192 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.498 HG21 HD22 ' A' ' 22' ' ' LEU . 1.2 p -100.88 121.8 52.13 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.59 0 N-CA-C 109.325 -0.621 . . . . 0.0 109.325 172.461 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.571 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 14.8 tp10 -53.59 -57.22 11.52 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.554 1.142 . . . . 0.0 110.821 172.416 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.2 ptmt -164.21 162.03 22.42 Favored 'General case' 0 C--O 1.241 0.61 0 CA-C-N 115.632 -0.713 . . . . 0.0 110.995 -174.26 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.494 HG13 ' HB3' ' A' ' 20' ' ' TYR . 85.9 t -85.28 116.71 29.1 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.547 0 N-CA-C 108.518 -0.919 . . . . 0.0 108.518 173.599 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 57.1 mt -82.9 -35.69 25.93 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.013 0.525 . . . . 0.0 111.888 -177.701 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.1 t70 -164.56 162.73 21.84 Favored 'General case' 0 N--CA 1.474 0.747 0 O-C-N 123.259 0.349 . . . . 0.0 110.995 -171.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.484 ' NH2' HD21 ' A' ' 50' ' ' LEU . 31.3 ttm180 -118.59 149.26 41.66 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.309 1.044 . . . . 0.0 109.539 173.538 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 37.0 ptt180 -132.2 160.78 35.12 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 108.544 -0.909 . . . . 0.0 108.544 165.651 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 85.9 t -120.95 108.46 22.76 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.393 0 N-CA-C 107.587 -1.264 . . . . 0.0 107.587 167.327 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 42.5 t -123.61 128.56 74.58 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 177.371 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 62.4 m-20 66.02 22.2 11.23 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.843 1.257 . . . . 0.0 111.772 -178.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.45 6.08 89.05 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.781 -0.645 . . . . 0.0 113.357 -176.056 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 6.5 ttmm -104.26 143.13 33.37 Favored 'General case' 0 C--N 1.348 0.523 0 C-N-CA 124.285 1.034 . . . . 0.0 109.702 -177.856 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 61.3 t -91.08 119.45 38.27 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.632 0 CA-C-N 114.969 -1.014 . . . . 0.0 109.402 -177.92 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.53 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 43.0 mt-10 -128.19 162.71 26.34 Favored 'General case' 0 N--CA 1.473 0.722 0 C-N-CA 124.144 0.978 . . . . 0.0 109.576 -178.919 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.494 ' HB3' HG13 ' A' ' 8' ' ' VAL . 87.7 m-85 -140.68 134.45 30.39 Favored 'General case' 0 N--CA 1.472 0.675 0 C-N-CA 123.528 0.731 . . . . 0.0 110.147 -172.56 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 49.0 t80 -78.51 106.94 10.81 Favored 'General case' 0 C--O 1.239 0.514 0 N-CA-C 107.877 -1.157 . . . . 0.0 107.877 174.502 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.688 HD11 HD22 ' A' ' 40' ' ' LEU . 28.4 mt -87.98 123.35 32.6 Favored 'General case' 0 C--O 1.235 0.318 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.351 -176.973 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.9 tmtm? -78.11 99.45 6.16 Favored 'General case' 0 N--CA 1.448 -0.56 0 N-CA-C 106.671 -1.603 . . . . 0.0 106.671 167.052 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.551 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 63.0 m95 -63.88 126.26 27.05 Favored 'General case' 0 CA--C 1.546 0.826 0 N-CA-C 109.23 -0.656 . . . . 0.0 109.23 171.427 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.571 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 38.0 ttpt -51.21 -54.44 25.59 Favored 'General case' 0 CA--C 1.548 0.869 0 C-N-CA 125.411 1.484 . . . . 0.0 113.516 -164.589 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -103.75 30.69 9.78 Favored Glycine 0 CA--C 1.528 0.895 0 CA-C-N 116.78 -0.191 . . . . 0.0 112.855 -178.404 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.551 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.6 m-85 -135.55 142.21 45.33 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.375 0.67 . . . . 0.0 110.234 -178.859 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 73.8 p -64.75 159.24 22.77 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.251 1.02 . . . . 0.0 112.141 -175.506 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.1 p-10 -63.23 -34.81 78.46 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.298 0.639 . . . . 0.0 112.064 -177.005 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.82 -19.3 64.27 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 123.424 0.69 . . . . 0.0 111.546 176.762 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.9 t70 -99.82 -18.4 17.19 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.452 1.101 . . . . 0.0 110.844 179.541 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.482 ' HB3' ' O ' ' A' ' 22' ' ' LEU . 11.8 m120 -68.11 146.61 53.29 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.195 0.598 . . . . 0.0 111.183 175.821 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 42.7 p -126.07 165.06 19.54 Favored 'General case' 0 N--CA 1.488 1.426 0 C-N-CA 123.32 0.648 . . . . 0.0 112.358 -166.333 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.4 m95 -88.4 116.9 26.95 Favored 'General case' 0 N--CA 1.477 0.875 0 C-N-CA 123.993 0.917 . . . . 0.0 109.847 173.089 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.7 mm-40 -121.8 133.62 24.35 Favored Pre-proline 0 CA--C 1.539 0.533 0 C-N-CA 123.688 0.795 . . . . 0.0 110.744 178.533 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.53 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 58.2 Cg_endo -69.26 156.07 65.72 Favored 'Trans proline' 0 C--N 1.373 1.866 0 C-N-CA 122.591 2.194 . . . . 0.0 111.667 176.472 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.419 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -51.49 -30.16 19.08 Favored 'General case' 0 N--CA 1.489 1.515 0 C-N-CA 124.367 1.067 . . . . 0.0 113.43 179.752 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 15.8 pt-20 -68.42 -37.91 80.73 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.336 0.654 . . . . 0.0 110.983 -179.57 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 57.7 t30 -89.83 3.26 53.49 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 123.491 0.717 . . . . 0.0 111.1 -173.672 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.688 HD22 HD11 ' A' ' 22' ' ' LEU . 10.8 mt -88.66 124.25 33.9 Favored 'General case' 0 N--CA 1.477 0.922 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 173.994 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.451 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 32.5 t70 -84.1 -33.57 24.32 Favored 'General case' 0 N--CA 1.474 0.741 0 N-CA-C 109.537 -0.542 . . . . 0.0 109.537 175.946 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.564 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 17.6 p -71.57 109.44 5.52 Favored Pre-proline 0 CA--C 1.555 1.143 0 C-N-CA 124.403 1.081 . . . . 0.0 110.839 174.364 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.451 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 73.4 Cg_endo -87.12 -19.39 2.52 Favored 'Trans proline' 0 C--N 1.374 1.917 0 C-N-CA 122.253 1.968 . . . . 0.0 111.953 170.923 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.9 tt0 -75.57 -35.58 60.57 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 123.932 0.893 . . . . 0.0 110.789 -173.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 74.2 mt -69.98 -32.63 70.94 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 122.614 0.366 . . . . 0.0 110.865 176.341 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 29.3 mt -68.49 -46.56 80.12 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 N-CA-C 109.089 -0.708 . . . . 0.0 109.089 178.244 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . 0.402 ' HG2' ' ND2' ' A' ' 51' ' ' ASN . 37.1 tt0 -62.13 -45.23 94.36 Favored 'General case' 0 N--CA 1.47 0.557 0 CA-C-N 115.051 -0.977 . . . . 0.0 110.51 178.846 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.74 -32.14 73.25 Favored 'General case' 0 CA--C 1.55 0.962 0 C-N-CA 123.173 0.589 . . . . 0.0 111.627 -178.801 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.6 t80 -63.45 -40.19 96.48 Favored 'General case' 0 N--CA 1.482 1.16 0 C-N-CA 123.85 0.86 . . . . 0.0 110.501 173.08 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.484 HD21 ' NH2' ' A' ' 11' ' ' ARG . 91.4 mt -73.22 -34.79 66.11 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 115.732 -0.667 . . . . 0.0 110.363 178.068 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.45 ' HA ' ' HB2' ' A' ' 54' ' ' LYS . 91.0 m-20 -76.7 -14.97 59.91 Favored 'General case' 0 N--CA 1.486 1.332 0 C-N-CA 123.835 0.854 . . . . 0.0 111.084 179.578 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 33.3 t -70.48 -37.21 74.22 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.336 -0.616 . . . . 0.0 109.336 169.868 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.0 mt-30 -78.06 -34.94 50.12 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 115.129 -0.941 . . . . 0.0 109.987 176.826 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.45 ' HB2' ' HA ' ' A' ' 51' ' ' ASN . 30.4 mmmt . . . . . 0 C--O 1.251 1.178 0 C-N-CA 124.076 0.951 . . . . 0.0 110.312 -176.366 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.325 0 N-CA-C 110.003 -0.369 . . . . 0.0 110.003 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 64.6 mtt180 57.78 28.5 16.02 Favored 'General case' 0 N--CA 1.493 1.71 0 C-N-CA 124.179 0.991 . . . . 0.0 111.468 179.897 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 39.6 p -76.47 91.45 3.33 Favored 'General case' 0 C--O 1.244 0.789 0 C-N-CA 124.003 0.921 . . . . 0.0 110.74 -172.415 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 22.7 ttmm -80.52 79.51 7.11 Favored 'General case' 0 CA--C 1.539 0.557 0 CA-C-O 122.246 1.022 . . . . 0.0 110.281 -179.536 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.564 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 46.1 tt0 -140.73 19.0 2.34 Favored 'General case' 0 CA--C 1.553 1.079 0 CA-C-N 114.145 -1.389 . . . . 0.0 108.563 177.889 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.513 HG22 HG22 ' A' ' 4' ' ' VAL . 21.8 p -96.27 179.42 5.05 Favored 'General case' 0 C--O 1.246 0.92 0 C-N-CA 124.284 1.033 . . . . 0.0 111.55 -176.425 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -176.97 179.97 0.98 Allowed 'General case' 0 C--O 1.246 0.912 0 C-N-CA 125.336 1.454 . . . . 0.0 108.71 177.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 58.1 ttp85 -128.29 156.05 43.65 Favored 'General case' 0 N--CA 1.471 0.601 0 C-N-CA 123.805 0.842 . . . . 0.0 108.839 -179.561 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.468 0.435 0 C-N-CA 122.779 0.432 . . . . 0.0 110.522 175.295 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 31.3 p -74.25 151.04 39.98 Favored 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.178 0.991 . . . . 0.0 110.31 177.563 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 52.8 p -90.06 31.28 0.99 Allowed 'General case' 0 CA--C 1.554 1.105 0 C-N-CA 123.888 0.875 . . . . 0.0 110.183 179.735 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -68.36 -48.76 49.81 Favored Glycine 0 C--N 1.355 1.638 0 CA-C-N 115.681 -0.69 . . . . 0.0 112.324 179.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 69.25 -83.69 0.25 Allowed Glycine 0 C--N 1.354 1.539 0 C-N-CA 123.209 0.433 . . . . 0.0 112.691 176.843 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 4.7 mptp? -83.11 -21.88 33.53 Favored 'General case' 0 N--CA 1.483 1.199 0 C-N-CA 124.106 0.963 . . . . 0.0 110.101 174.979 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.144 0 C-N-CA 123.566 0.746 . . . . 0.0 110.277 173.929 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.529 0 N-CA-C 111.896 -0.482 . . . . 0.0 111.896 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.1 mt-10 -91.06 115.77 28.28 Favored 'General case' 0 N--CA 1.473 0.703 0 N-CA-C 108.733 -0.84 . . . . 0.0 108.733 173.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 52.9 m-85 -117.26 142.26 47.28 Favored 'General case' 0 N--CA 1.472 0.672 0 C-N-CA 123.391 0.677 . . . . 0.0 110.14 -178.301 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 6.0 p -75.65 122.5 29.67 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.747 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 176.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.551 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -97.26 134.9 33.38 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 C-N-CA 123.657 0.783 . . . . 0.0 109.427 175.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -69.0 -55.98 9.18 Favored 'General case' 0 N--CA 1.47 0.551 0 C-N-CA 124.003 0.921 . . . . 0.0 109.752 179.373 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.0 ptmt -162.92 166.75 23.55 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.443 0.697 . . . . 0.0 110.875 -174.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.414 HG11 ' HD2' ' A' ' 20' ' ' TYR . 60.0 t -90.41 142.34 13.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.711 0 N-CA-C 108.726 -0.842 . . . . 0.0 108.726 169.941 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 84.7 mt -106.77 -45.58 4.17 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.707 0.803 . . . . 0.0 111.058 -178.808 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 29.5 t70 -149.6 161.85 41.35 Favored 'General case' 0 N--CA 1.471 0.601 0 CA-C-O 120.811 0.339 . . . . 0.0 110.933 -175.559 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 61.7 ttt-85 -122.42 151.87 40.8 Favored 'General case' 0 N--CA 1.471 0.582 0 C-N-CA 125.092 1.357 . . . . 0.0 108.605 179.291 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 12.2 ptm180 -153.23 163.58 39.63 Favored 'General case' 0 N--CA 1.478 0.931 0 C-N-CA 123.123 0.569 . . . . 0.0 110.272 176.738 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 86.2 t -117.59 115.11 47.55 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.746 0 C-N-CA 123.961 0.904 . . . . 0.0 109.178 175.342 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.413 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 88.6 t -116.45 109.85 29.45 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.362 1.065 . . . . 0.0 109.47 -177.824 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 17.8 m120 60.93 17.92 8.32 Favored 'General case' 0 N--CA 1.497 1.92 0 C-N-CA 124.303 1.041 . . . . 0.0 112.851 177.91 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 111.91 -24.38 14.93 Favored Glycine 0 C--N 1.347 1.159 0 CA-C-O 119.829 -0.428 . . . . 0.0 113.367 -178.512 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.413 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 13.6 ptmt -81.92 170.98 14.99 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 122.951 0.5 . . . . 0.0 109.823 -179.587 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 71.6 t -120.54 118.57 57.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.008 0 C-N-CA 123.229 0.612 . . . . 0.0 110.214 179.683 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.571 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 61.6 mt-10 -111.02 152.23 27.09 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.809 0.844 . . . . 0.0 110.687 177.49 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.434 ' HE1' ' HB3' ' A' ' 37' ' ' GLU . 94.0 m-85 -130.09 126.9 38.72 Favored 'General case' 0 N--CA 1.475 0.807 0 C-N-CA 124.651 1.18 . . . . 0.0 109.268 -176.216 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 21.5 t80 -78.32 108.35 11.6 Favored 'General case' 0 N--CA 1.473 0.708 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 178.696 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.481 HD11 HD22 ' A' ' 40' ' ' LEU . 39.9 mt -90.29 122.39 33.15 Favored 'General case' 0 C--N 1.333 -0.151 0 CA-C-N 115.58 -0.736 . . . . 0.0 110.722 -174.225 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -79.37 96.79 6.11 Favored 'General case' 0 C--N 1.342 0.277 0 N-CA-C 106.321 -1.733 . . . . 0.0 106.321 163.189 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.56 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.5 m95 -67.88 135.27 52.23 Favored 'General case' 0 CA--C 1.539 0.544 0 O-C-N 123.364 0.415 . . . . 0.0 110.241 179.231 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 24.9 ttmm -69.92 131.25 44.13 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 175.089 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.9 -35.27 3.82 Favored Glycine 0 C--N 1.347 1.145 0 O-C-N 123.314 0.384 . . . . 0.0 112.903 -178.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.56 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 64.6 m-85 -91.65 144.74 25.21 Favored 'General case' 0 N--CA 1.476 0.839 0 C-N-CA 123.636 0.775 . . . . 0.0 109.875 -178.771 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 58.1 p -73.77 163.37 28.05 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.861 0.864 . . . . 0.0 112.1 -174.173 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.429 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.9 p-10 -59.55 -33.76 71.82 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.846 0.858 . . . . 0.0 111.389 -179.484 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.03 -28.1 60.31 Favored 'General case' 0 CA--C 1.547 0.832 0 C-N-CA 123.846 0.858 . . . . 0.0 111.839 178.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -88.51 -11.87 44.53 Favored 'General case' 0 CA--C 1.549 0.913 0 C-N-CA 123.491 0.716 . . . . 0.0 111.25 -179.293 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.552 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.8 m120 -63.25 157.66 22.12 Favored 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 177.945 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 6.1 p -143.65 154.67 43.76 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.488 0.715 . . . . 0.0 111.403 -172.707 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.3 m95 -77.54 124.02 27.37 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.899 0.88 . . . . 0.0 109.139 171.787 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.8 mm-40 -124.68 129.63 24.55 Favored Pre-proline 0 N--CA 1.468 0.458 0 C-N-CA 123.15 0.58 . . . . 0.0 110.761 176.099 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.571 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 51.4 Cg_endo -66.7 159.82 49.35 Favored 'Trans proline' 0 C--N 1.371 1.723 0 C-N-CA 122.685 2.257 . . . . 0.0 111.91 177.313 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.434 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -64.69 -24.77 67.68 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.551 0.74 . . . . 0.0 112.786 -176.277 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 14.0 pt-20 -64.02 -31.45 72.64 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.961 0.904 . . . . 0.0 110.624 174.601 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 64.2 t30 -92.03 -12.86 32.02 Favored 'General case' 0 CA--C 1.551 1.007 0 C-N-CA 124.525 1.13 . . . . 0.0 111.216 -172.6 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.481 HD22 HD11 ' A' ' 22' ' ' LEU . 21.5 mt -86.53 120.97 28.43 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.502 0.721 . . . . 0.0 110.346 -178.469 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . 0.487 ' O ' ' HD3' ' A' ' 43' ' ' PRO . 26.9 t70 -83.08 -30.1 28.26 Favored 'General case' 0 N--CA 1.476 0.853 0 N-CA-C 109.685 -0.487 . . . . 0.0 109.685 173.451 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 19.1 p -78.23 106.29 3.87 Favored Pre-proline 0 CA--C 1.559 1.319 0 C-N-CA 124.8 1.24 . . . . 0.0 112.164 -177.603 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.487 ' HD3' ' O ' ' A' ' 41' ' ' ASP . 64.8 Cg_endo -87.96 -18.51 2.31 Favored 'Trans proline' 0 C--N 1.378 2.111 0 C-N-CA 122.736 2.291 . . . . 0.0 113.064 175.066 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . 0.429 ' HB3' ' OE1' ' B' ' 5' ' ' GLN . 35.2 tt0 -75.25 -36.22 61.3 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.722 0.809 . . . . 0.0 110.441 -174.976 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 61.8 mt -67.22 -39.7 86.3 Favored 'General case' 0 N--CA 1.481 1.089 0 CA-C-N 116.344 -0.389 . . . . 0.0 111.113 174.445 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.501 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 62.7 mt -63.39 -47.55 91.35 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 N-CA-C 109.147 -0.686 . . . . 0.0 109.147 176.548 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.1 tt0 -58.97 -53.27 60.25 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 124.264 1.026 . . . . 0.0 111.296 -178.812 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.92 -33.63 74.6 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.609 0.764 . . . . 0.0 111.109 -178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 50.4 t80 -71.34 -36.87 71.69 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.169 0.988 . . . . 0.0 111.421 176.228 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.501 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 96.8 mt -67.83 -36.72 80.85 Favored 'General case' 0 N--CA 1.485 1.299 0 N-CA-C 109.595 -0.521 . . . . 0.0 109.595 176.537 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 71.9 m-20 -67.27 -28.41 68.01 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.256 1.022 . . . . 0.0 110.529 174.9 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 48.9 m -74.81 -38.04 62.19 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.198 0.599 . . . . 0.0 110.557 175.58 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.499 ' NE2' HD23 ' A' ' 50' ' ' LEU . 46.5 mt-30 -70.16 -35.51 74.06 Favored 'General case' 0 N--CA 1.475 0.779 0 CA-C-N 116.246 -0.433 . . . . 0.0 110.803 179.531 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 14.3 tppt? . . . . . 0 CA--C 1.549 0.928 0 N-CA-C 109.556 -0.535 . . . . 0.0 109.556 -176.862 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.012 0 N-CA-C 110.038 -0.356 . . . . 0.0 110.038 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 2.8 tmt_? -65.08 -67.38 0.44 Allowed 'General case' 0 N--CA 1.476 0.833 0 N-CA-C 108.746 -0.835 . . . . 0.0 108.746 176.198 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 43.2 p -86.42 150.38 24.34 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.069 0.547 . . . . 0.0 109.574 174.048 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 64.3 mttm -73.81 135.57 43.49 Favored 'General case' 0 C--O 1.244 0.791 0 N-CA-C 108.152 -1.055 . . . . 0.0 108.152 170.393 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.429 ' OE1' ' HB3' ' A' ' 44' ' ' GLU . 33.3 mm-40 -62.72 97.17 0.1 Allowed 'General case' 0 N--CA 1.468 0.444 0 O-C-N 123.887 0.742 . . . . 0.0 111.053 -172.905 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 8.8 t -127.22 159.87 32.99 Favored 'General case' 0 C--O 1.244 0.792 0 C-N-CA 123.81 0.844 . . . . 0.0 110.43 -173.599 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -156.55 163.83 38.92 Favored 'General case' 0 C--O 1.238 0.458 0 C-N-CA 124.987 1.315 . . . . 0.0 108.094 173.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.469 ' HD2' ' N ' ' B' ' 8' ' ' ARG . 1.8 mpt_? -101.92 176.94 5.04 Favored 'General case' 0 N--CA 1.473 0.679 0 N-CA-C 108.066 -1.087 . . . . 0.0 108.066 178.465 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.797 0 O-C-N 122.04 -0.412 . . . . 0.0 110.022 175.122 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 22.8 t -59.89 108.55 0.77 Allowed 'General case' 0 C--O 1.246 0.873 0 C-N-CA 125.096 1.358 . . . . 0.0 110.693 -170.004 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 23.7 m -71.31 100.21 2.09 Favored 'General case' 0 CA--C 1.546 0.815 0 CA-C-N 115.41 -0.814 . . . . 0.0 110.009 -177.909 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.66 135.18 17.68 Favored Glycine 0 C--N 1.342 0.902 0 CA-C-N 115.266 -0.879 . . . . 0.0 112.791 -177.723 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -94.1 93.54 1.7 Allowed Glycine 0 C--N 1.346 1.107 0 C-N-CA 123.328 0.49 . . . . 0.0 112.051 -178.459 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 45.7 mtmt -79.99 73.01 6.79 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.597 0.759 . . . . 0.0 109.437 175.051 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.246 0.887 0 CA-C-N 115.697 -0.683 . . . . 0.0 109.584 -173.801 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.482 1.766 0 N-CA-C 111.978 -0.449 . . . . 0.0 111.978 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 41.5 mm-40 -104.41 -44.71 4.86 Favored 'General case' 0 N--CA 1.481 1.1 0 C-N-CA 124.037 0.935 . . . . 0.0 111.2 -177.81 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 30.4 m-85 -110.17 119.36 39.02 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 123.798 0.839 . . . . 0.0 109.921 -167.267 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.459 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 18.9 t -78.44 134.0 29.03 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.674 0 C-N-CA 122.75 0.42 . . . . 0.0 110.613 -174.553 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.45 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.4 p -112.92 135.82 51.15 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.871 0 C-N-CA 124.865 1.266 . . . . 0.0 110.285 -179.911 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.689 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 18.1 tp10 -70.05 -54.82 11.42 Favored 'General case' 0 CA--C 1.546 0.81 0 C-N-CA 124.924 1.29 . . . . 0.0 110.962 175.842 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.689 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.19 169.08 5.57 Favored 'General case' 0 N--CA 1.488 1.433 0 C-N-CA 124.034 0.934 . . . . 0.0 111.104 170.827 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 86.5 t -77.16 141.26 15.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.762 0 CA-C-N 115.693 -0.685 . . . . 0.0 109.966 172.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 75.1 mt -109.34 -41.15 4.71 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.645 0.778 . . . . 0.0 111.179 179.644 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 37.2 t0 -147.12 164.28 33.6 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.886 0.474 . . . . 0.0 110.322 -169.333 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 22.1 ttt180 -132.89 151.63 52.0 Favored 'General case' 0 N--CA 1.482 1.152 0 C-N-CA 124.423 1.089 . . . . 0.0 110.137 -178.489 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 15.2 ptm180 -148.68 163.89 35.96 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 124.219 1.007 . . . . 0.0 109.522 174.16 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 57.0 t -115.99 108.37 24.99 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 107.907 -1.146 . . . . 0.0 107.907 170.08 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 89.1 t -91.34 110.2 22.15 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 N-CA-C 108.672 -0.862 . . . . 0.0 108.672 176.82 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 14.5 m120 66.68 -73.3 0.08 Allowed 'General case' 0 N--CA 1.482 1.144 0 C-N-CA 124.955 1.302 . . . . 0.0 111.201 -176.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -160.26 34.66 0.43 Allowed Glycine 0 C--N 1.336 0.574 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 175.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 12.4 ptmt -130.82 151.54 51.14 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 123.469 0.708 . . . . 0.0 109.601 177.509 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 95.3 t -90.54 130.15 40.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.662 0 C-N-CA 122.634 0.374 . . . . 0.0 110.19 175.931 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.467 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 25.9 mt-10 -124.97 149.05 48.09 Favored 'General case' 0 N--CA 1.471 0.616 0 C-N-CA 123.728 0.811 . . . . 0.0 109.739 170.379 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.504 ' HB2' HD11 ' A' ' 40' ' ' LEU . 92.4 m-85 -122.93 132.59 54.23 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 124.22 1.008 . . . . 0.0 110.026 -178.561 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 73.5 t80 -78.12 109.38 12.16 Favored 'General case' 0 N--CA 1.47 0.548 0 C-N-CA 124.194 0.997 . . . . 0.0 108.778 178.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.514 HD11 HD22 ' A' ' 40' ' ' LEU . 20.6 mt -88.81 126.07 35.19 Favored 'General case' 0 C--O 1.236 0.379 0 C-N-CA 123.06 0.544 . . . . 0.0 111.139 -176.488 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.6 tmtp? -80.0 107.43 12.78 Favored 'General case' 0 C--O 1.219 -0.526 0 N-CA-C 105.573 -2.01 . . . . 0.0 105.573 162.181 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.529 ' CD1' ' HA ' ' A' ' 32' ' ' ASN . 90.3 m95 -72.33 134.38 45.46 Favored 'General case' 0 N--CA 1.472 0.653 0 C-N-CA 122.591 0.356 . . . . 0.0 110.795 -179.654 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 53.3 tttm -69.83 -60.78 2.09 Favored 'General case' 0 N--CA 1.468 0.464 0 C-N-CA 123.844 0.858 . . . . 0.0 111.158 -173.067 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -97.76 32.84 6.38 Favored Glycine 0 C--N 1.344 0.976 0 CA-C-N 115.774 -0.648 . . . . 0.0 113.321 -176.012 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.41 ' HD2' ' HB3' ' A' ' 24' ' ' TRP . 85.4 m-85 -137.27 163.91 29.8 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 124.124 0.969 . . . . 0.0 108.689 175.854 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 13.7 t -72.57 164.96 25.61 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.096 0.558 . . . . 0.0 111.619 -175.135 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 8.5 t70 -73.12 -42.95 62.36 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 123.662 0.785 . . . . 0.0 112.692 -165.317 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.53 -13.66 60.7 Favored 'General case' 0 N--CA 1.491 1.602 0 C-N-CA 122.986 0.515 . . . . 0.0 111.858 -179.403 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.5 t70 -79.35 -10.89 59.91 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.218 1.007 . . . . 0.0 111.994 179.096 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.529 ' HA ' ' CD1' ' A' ' 24' ' ' TRP . 9.9 m120 -64.99 136.13 56.45 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.117 0.567 . . . . 0.0 112.319 -174.429 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 20.3 p -138.4 162.29 34.79 Favored 'General case' 0 N--CA 1.489 1.486 0 C-N-CA 123.249 0.62 . . . . 0.0 112.341 -165.632 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -79.0 123.11 26.98 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.515 1.126 . . . . 0.0 111.123 176.397 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.42 ' HB2' HD21 ' A' ' 40' ' ' LEU . 57.2 mm-40 -121.65 135.1 24.88 Favored Pre-proline 0 CA--C 1.543 0.691 0 N-CA-C 108.942 -0.762 . . . . 0.0 108.942 171.913 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.467 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 38.5 Cg_endo -65.35 155.87 66.33 Favored 'Trans proline' 0 C--N 1.372 1.764 0 C-N-CA 122.329 2.019 . . . . 0.0 111.333 175.046 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.401 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -58.01 -26.24 62.13 Favored 'General case' 0 N--CA 1.484 1.241 0 C-N-CA 123.74 0.816 . . . . 0.0 112.502 -178.923 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.424 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 10.4 pt-20 -71.64 -27.94 63.43 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.451 0.701 . . . . 0.0 110.841 178.63 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.484 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.7 m-20 -88.7 -16.37 32.47 Favored 'General case' 0 N--CA 1.479 1.002 0 C-N-CA 123.924 0.89 . . . . 0.0 111.43 177.636 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.514 HD22 HD11 ' A' ' 22' ' ' LEU . 23.6 mt -77.28 124.9 28.48 Favored 'General case' 0 N--CA 1.477 0.878 0 C-N-CA 122.723 0.409 . . . . 0.0 110.362 -179.381 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.1 t70 -112.97 24.0 12.82 Favored 'General case' 0 CA--C 1.549 0.922 0 N-CA-C 108.389 -0.967 . . . . 0.0 108.389 175.025 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.1 p -121.29 89.11 46.45 Favored Pre-proline 0 CA--C 1.55 0.958 0 C-N-CA 123.652 0.781 . . . . 0.0 110.286 -176.763 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . 0.434 ' HD2' HE22 ' B' ' 5' ' ' GLN . 29.0 Cg_exo -65.35 -48.17 3.64 Favored 'Trans proline' 0 C--N 1.376 1.982 0 C-N-CA 123.063 2.509 . . . . 0.0 113.736 -177.44 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 37.3 mt-10 -64.42 -29.57 70.62 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 123.696 0.799 . . . . 0.0 112.165 -173.738 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.473 HD13 ' HA ' ' A' ' 7' ' ' LYS . 53.1 mt -78.04 -35.84 49.24 Favored 'General case' 0 C--O 1.241 0.639 0 C-N-CA 123.399 0.68 . . . . 0.0 111.426 -176.669 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 71.6 mt -65.2 -47.51 87.2 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.844 0 N-CA-C 108.761 -0.829 . . . . 0.0 108.761 171.661 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.3 tt0 -56.41 -46.02 80.39 Favored 'General case' 0 C--O 1.211 -0.924 0 CA-C-N 114.748 -1.114 . . . . 0.0 111.191 177.095 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.43 -37.13 84.66 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.028 0.931 . . . . 0.0 110.923 -176.054 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 59.9 t80 -68.16 -46.35 71.01 Favored 'General case' 0 CA--C 1.549 0.912 0 CA-C-N 114.965 -1.016 . . . . 0.0 110.918 176.954 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 79.3 mt -70.23 -24.25 63.06 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.321 0.649 . . . . 0.0 110.178 177.649 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 18.7 t-20 -74.78 -25.75 59.28 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.622 1.169 . . . . 0.0 109.853 179.745 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 16.2 m -72.13 -27.16 62.43 Favored 'General case' 0 CA--C 1.548 0.9 0 CA-C-N 115.859 -0.61 . . . . 0.0 110.52 172.924 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 65.7 mt-30 -80.92 -13.32 59.02 Favored 'General case' 0 N--CA 1.485 1.292 0 C-N-CA 124.014 0.926 . . . . 0.0 110.887 173.187 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 16.7 tppt? . . . . . 0 C--O 1.251 1.158 0 C-N-CA 124.462 1.105 . . . . 0.0 109.765 -178.853 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.18 0 N-CA-C 109.763 -0.458 . . . . 0.0 109.763 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 95.2 mtt180 76.19 -49.85 0.59 Allowed 'General case' 0 N--CA 1.493 1.691 0 C-N-CA 125.515 1.526 . . . . 0.0 112.919 176.047 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 4.6 t -54.13 94.68 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.107 0 C-N-CA 124.333 1.053 . . . . 0.0 111.951 178.6 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 3.9 ttmp? -81.1 83.06 6.86 Favored 'General case' 0 C--N 1.35 0.625 0 CA-C-N 115.567 -0.742 . . . . 0.0 109.116 178.922 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.434 HE22 ' HD2' ' A' ' 43' ' ' PRO . 16.0 mm-40 -72.57 117.97 14.9 Favored 'General case' 0 CA--C 1.532 0.272 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.205 178.85 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.459 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 10.1 t -131.94 179.12 6.27 Favored 'General case' 0 CA--C 1.542 0.652 0 CA-C-N 115.375 -0.83 . . . . 0.0 110.349 -165.508 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -158.89 -179.61 8.22 Favored 'General case' 0 CA--C 1.539 0.53 0 C-N-CA 123.84 0.856 . . . . 0.0 110.635 -178.771 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.484 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 76.6 ttt180 -130.27 129.11 42.86 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 125.082 1.353 . . . . 0.0 107.698 -173.072 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.417 ' HA ' ' OE1' ' A' ' 35' ' ' GLU . . . . . . . . 0 N--CA 1.484 1.264 0 CA-C-N 118.912 0.778 . . . . 0.0 112.609 -174.926 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 39.9 m -143.43 144.94 32.23 Favored 'General case' 0 N--CA 1.469 0.483 0 C-N-CA 123.07 0.548 . . . . 0.0 109.655 179.321 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 49.1 m -71.59 85.5 0.88 Allowed 'General case' 0 CA--C 1.55 0.956 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 173.665 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -101.59 117.0 5.71 Favored Glycine 0 C--N 1.35 1.31 0 CA-C-N 115.313 -0.858 . . . . 0.0 111.867 -179.561 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -101.99 -87.32 1.98 Allowed Glycine 0 C--N 1.347 1.184 0 N-CA-C 110.303 -1.119 . . . . 0.0 110.303 177.93 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 17.7 tppt? -157.91 -80.95 0.06 Allowed 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 123.541 0.737 . . . . 0.0 109.651 177.676 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.108 0 C-N-CA 123.716 0.806 . . . . 0.0 109.372 -177.701 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.483 0 N-CA-C 111.331 -0.708 . . . . 0.0 111.331 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.464 ' HG2' ' HA ' ' B' ' 8' ' ' ARG . 9.5 pt-20 -137.45 -17.82 1.3 Allowed 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 123.21 0.604 . . . . 0.0 111.77 -179.024 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 92.2 m-85 -141.27 136.59 31.77 Favored 'General case' 0 N--CA 1.492 1.629 0 C-N-CA 123.259 0.624 . . . . 0.0 110.311 177.85 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 30.6 m -73.45 134.86 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.065 0 C-N-CA 123.567 0.747 . . . . 0.0 111.362 -179.51 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.434 HG21 HD22 ' A' ' 22' ' ' LEU . 1.7 p -125.79 133.5 68.91 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.666 0 C-N-CA 123.511 0.724 . . . . 0.0 110.014 174.838 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.822 ' HG3' ' HD2' ' A' ' 7' ' ' LYS . 10.6 tp10 -56.11 -64.84 0.73 Allowed 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 125.364 1.466 . . . . 0.0 110.58 172.875 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.822 ' HD2' ' HG3' ' A' ' 6' ' ' GLU . 0.0 OUTLIER -172.83 170.12 4.68 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 124.313 1.045 . . . . 0.0 110.689 169.831 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.468 ' HB ' ' HB2' ' A' ' 49' ' ' PHE . 63.4 t -66.07 139.55 21.03 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.698 0 CA-C-N 115.188 -0.915 . . . . 0.0 110.07 172.033 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . 0.432 HD11 ' HB2' ' A' ' 23' ' ' LYS . 86.3 mt -111.63 -30.14 7.46 Favored 'General case' 0 C--O 1.241 0.64 0 C-N-CA 123.78 0.832 . . . . 0.0 110.865 -177.869 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -159.43 163.39 35.46 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 122.638 0.375 . . . . 0.0 110.702 -172.905 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 59.0 ttt180 -136.33 147.69 47.53 Favored 'General case' 0 N--CA 1.483 1.189 0 C-N-CA 124.103 0.961 . . . . 0.0 110.397 -176.869 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.8 ptm180 -151.09 172.72 15.32 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 124.473 1.109 . . . . 0.0 108.821 174.593 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 98.4 t -129.98 118.54 44.57 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.968 0 C-N-CA 123.518 0.727 . . . . 0.0 109.273 174.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 59.1 t -125.98 123.82 64.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.986 0 C-N-CA 124.078 0.951 . . . . 0.0 109.335 177.392 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.9 m120 62.99 26.72 15.64 Favored 'General case' 0 N--CA 1.487 1.42 0 C-N-CA 124.763 1.225 . . . . 0.0 111.969 175.654 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 93.76 -23.5 30.48 Favored Glycine 0 C--N 1.347 1.167 0 CA-C-N 115.682 -0.69 . . . . 0.0 112.269 -178.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ttpt -77.66 148.95 34.77 Favored 'General case' 0 CA--C 1.538 0.492 0 C-N-CA 124.711 1.205 . . . . 0.0 109.458 -178.542 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 48.9 t -106.12 116.06 49.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.725 0 N-CA-C 108.807 -0.812 . . . . 0.0 108.807 179.431 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.629 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.8 mt-10 -104.41 154.62 19.63 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.383 0.673 . . . . 0.0 110.261 -178.062 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.433 ' HD1' HG11 ' A' ' 8' ' ' VAL . 91.1 m-85 -138.48 124.27 19.86 Favored 'General case' 0 N--CA 1.472 0.626 0 C-N-CA 124.484 1.114 . . . . 0.0 109.519 -175.327 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 63.1 t80 -78.5 109.3 12.55 Favored 'General case' 0 N--CA 1.472 0.628 0 N-CA-C 109.028 -0.73 . . . . 0.0 109.028 -178.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.434 HD22 HG21 ' A' ' 5' ' ' VAL . 54.2 mt -96.36 127.66 42.56 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 123.613 0.765 . . . . 0.0 111.209 -172.849 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.439 ' HB3' ' HB3' ' A' ' 6' ' ' GLU . 3.4 tmtp? -80.11 96.87 6.63 Favored 'General case' 0 C--N 1.347 0.484 0 N-CA-C 106.484 -1.673 . . . . 0.0 106.484 167.18 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.577 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 92.5 m95 -63.95 117.58 7.22 Favored 'General case' 0 CA--C 1.533 0.32 0 N-CA-C 109.298 -0.63 . . . . 0.0 109.298 176.4 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.407 ' HE2' ' HE2' ' B' ' 4' ' ' LYS . 13.1 ttpp -66.11 -34.19 77.5 Favored 'General case' 0 CA--C 1.546 0.809 0 O-C-N 124.22 0.95 . . . . 0.0 111.829 -168.571 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.73 16.95 60.13 Favored Glycine 0 C--N 1.343 0.965 0 CA-C-N 115.977 -0.556 . . . . 0.0 113.604 -179.96 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.439 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 98.7 m-85 -139.01 157.57 45.76 Favored 'General case' 0 N--CA 1.481 1.101 0 C-N-CA 123.662 0.785 . . . . 0.0 110.058 -177.437 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 7.7 t -69.09 162.54 26.73 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.274 0.63 . . . . 0.0 111.865 -178.105 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 15.2 t70 -65.68 -34.42 78.17 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.328 -0.851 . . . . 0.0 111.854 -173.145 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.87 -22.34 60.79 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 123.088 0.555 . . . . 0.0 111.663 178.114 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.9 t70 -88.72 -3.78 58.69 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.833 0.853 . . . . 0.0 110.883 -177.369 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.577 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.7 m120 -70.03 138.35 52.07 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.06 0.544 . . . . 0.0 111.079 178.993 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 76.0 p -130.36 165.26 22.9 Favored 'General case' 0 N--CA 1.485 1.286 0 C-N-CA 123.37 0.668 . . . . 0.0 111.821 -170.198 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 93.1 m95 -83.95 116.41 22.78 Favored 'General case' 0 N--CA 1.475 0.787 0 C-N-CA 124.059 0.944 . . . . 0.0 110.146 173.653 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 71.6 mm-40 -117.14 131.56 23.94 Favored Pre-proline 0 N--CA 1.476 0.825 0 C-N-CA 123.074 0.549 . . . . 0.0 110.116 171.603 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.629 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.5 Cg_endo -66.5 165.3 25.56 Favored 'Trans proline' 0 C--N 1.367 1.542 0 C-N-CA 122.392 2.061 . . . . 0.0 113.001 175.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.41 ' HA ' ' HG ' ' A' ' 40' ' ' LEU . 0.0 OUTLIER -59.22 -29.14 67.3 Favored 'General case' 0 CA--C 1.553 1.09 0 C-N-CA 124.255 1.022 . . . . 0.0 112.546 -178.464 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -63.35 -34.03 76.82 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.749 0.819 . . . . 0.0 110.984 176.338 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 2.6 m-20 -77.11 -33.64 56.86 Favored 'General case' 0 N--CA 1.472 0.671 0 C-N-CA 123.568 0.747 . . . . 0.0 111.156 177.803 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.41 ' HG ' ' HA ' ' A' ' 37' ' ' GLU . 34.9 mt -62.08 124.98 22.3 Favored 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 122.517 0.327 . . . . 0.0 111.259 -174.766 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 37.9 t70 -108.23 19.54 19.77 Favored 'General case' 0 CA--C 1.551 0.99 0 CA-C-O 122.653 1.216 . . . . 0.0 108.151 174.175 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.431 ' O ' HG13 ' A' ' 46' ' ' ILE . 12.9 p -127.69 87.52 55.75 Favored Pre-proline 0 CA--C 1.543 0.704 0 CA-C-N 114.953 -1.021 . . . . 0.0 110.398 -176.725 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 56.8 Cg_endo -69.87 -27.32 26.11 Favored 'Trans proline' 0 C--N 1.377 2.058 0 C-N-CA 122.491 2.127 . . . . 0.0 111.786 174.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 12.1 pt-20 -68.15 -38.64 82.36 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.696 0.798 . . . . 0.0 111.187 178.801 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.554 HD13 ' HA ' ' A' ' 7' ' ' LYS . 77.6 mt -78.73 -23.59 45.37 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 123.259 0.624 . . . . 0.0 111.312 -178.822 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.431 HG13 ' O ' ' A' ' 42' ' ' CYS . 79.9 mt -67.3 -52.39 42.93 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.203 0 N-CA-C 108.732 -0.84 . . . . 0.0 108.732 169.261 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 33.3 tt0 -56.16 -44.8 79.63 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.401 1.081 . . . . 0.0 110.994 177.898 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -61.52 -43.98 97.89 Favored 'General case' 0 N--CA 1.475 0.795 0 CA-C-N 115.34 -0.845 . . . . 0.0 110.64 -177.909 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.468 ' HB2' ' HB ' ' A' ' 8' ' ' VAL . 43.4 t80 -59.43 -47.86 83.84 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 124.282 0.988 . . . . 0.0 111.102 177.054 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.411 ' HA ' HE21 ' A' ' 53' ' ' GLN . 86.1 mt -60.42 -38.59 84.57 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.442 0.697 . . . . 0.0 110.548 179.342 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 83.5 m-20 -73.91 -24.63 59.72 Favored 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.616 0.766 . . . . 0.0 111.284 178.262 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 52.5 m -82.2 -20.3 38.05 Favored 'General case' 0 N--CA 1.479 0.993 0 C-N-CA 123.266 0.626 . . . . 0.0 111.388 178.827 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.411 HE21 ' HA ' ' A' ' 50' ' ' LEU . 44.6 mt-30 -73.76 -70.78 0.36 Allowed 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 122.541 0.336 . . . . 0.0 110.527 178.117 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 34.5 mmtp . . . . . 0 N--CA 1.484 1.227 0 C-N-CA 124.478 1.111 . . . . 0.0 110.95 -175.938 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.806 0 N-CA-C 110.024 -0.361 . . . . 0.0 110.024 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 42.9 mtp180 -99.43 97.26 8.31 Favored 'General case' 0 N--CA 1.471 0.579 0 C-N-CA 123.071 0.548 . . . . 0.0 109.622 175.743 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 21.0 m -107.09 150.09 26.92 Favored 'General case' 0 CA--C 1.542 0.658 0 C-N-CA 123.467 0.707 . . . . 0.0 109.698 179.202 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.407 ' HE2' ' HE2' ' A' ' 25' ' ' LYS . 16.5 ptpt -102.38 34.85 2.61 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.951 0.9 . . . . 0.0 110.918 176.668 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -69.08 141.66 54.68 Favored 'General case' 0 CA--C 1.54 0.593 0 CA-C-N 115.536 -0.756 . . . . 0.0 109.007 178.353 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 42.8 p -93.2 170.89 9.29 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-O 122.492 1.139 . . . . 0.0 113.808 -164.901 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -151.27 -179.82 7.67 Favored 'General case' 0 C--O 1.241 0.637 0 CA-C-N 113.737 -1.574 . . . . 0.0 108.692 172.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.464 ' HA ' ' HG2' ' A' ' 2' ' ' GLU . 31.7 ttm180 -114.4 153.74 29.33 Favored 'General case' 0 N--CA 1.467 0.422 0 C-N-CA 123.601 0.761 . . . . 0.0 109.716 -175.798 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.715 0 C-N-CA 123.006 0.522 . . . . 0.0 110.106 171.344 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 51.0 p -113.97 88.37 2.83 Favored 'General case' 0 CA--C 1.54 0.567 0 CA-C-N 115.613 -0.721 . . . . 0.0 111.685 -170.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 93.4 m -74.81 -35.73 62.46 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.632 0.773 . . . . 0.0 109.574 168.664 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 90.18 -60.93 3.35 Favored Glycine 0 C--N 1.341 0.807 0 CA-C-N 115.576 -0.738 . . . . 0.0 111.92 179.601 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 90.04 -53.96 3.62 Favored Glycine 0 C--N 1.347 1.148 0 N-CA-C 111.807 -0.517 . . . . 0.0 111.807 -178.222 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.5 tmtt? -161.46 -50.65 0.04 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 N-CA-C 108.159 -1.052 . . . . 0.0 108.159 177.541 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.134 0 CA-C-N 115.232 -0.894 . . . . 0.0 108.843 177.639 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.453 0 N-CA-C 111.232 -0.747 . . . . 0.0 111.232 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 3.8 mp0 -76.87 132.24 39.03 Favored 'General case' 0 N--CA 1.472 0.67 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 -178.512 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 32.0 m-85 -82.53 122.44 28.07 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 109.153 -0.684 . . . . 0.0 109.153 -168.634 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 26.2 t -75.83 130.55 36.1 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.563 0 N-CA-C 109.604 -0.517 . . . . 0.0 109.604 178.807 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.494 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.5 p -106.57 119.61 56.35 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.643 0 C-N-CA 123.292 0.637 . . . . 0.0 109.927 174.644 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.425 ' HG3' ' HG2' ' A' ' 7' ' ' LYS . 11.7 tp10 -48.35 -57.17 6.41 Favored 'General case' 0 N--CA 1.478 0.965 0 C-N-CA 125.747 1.619 . . . . 0.0 110.989 172.089 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.425 ' HG2' ' HG3' ' A' ' 6' ' ' GLU . 3.6 ptpp? -170.36 156.94 5.87 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.72 0.808 . . . . 0.0 110.929 179.363 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.427 HG23 ' HB3' ' A' ' 45' ' ' LEU . 85.3 t -71.85 120.27 19.84 Favored 'Isoleucine or valine' 0 C--O 1.237 0.41 0 CA-C-N 115.128 -0.942 . . . . 0.0 108.869 169.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -87.75 -49.42 7.14 Favored 'General case' 0 N--CA 1.47 0.53 0 C-N-CA 123.265 0.626 . . . . 0.0 110.841 -178.914 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.2 t0 -147.8 164.88 32.25 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 116.142 -0.481 . . . . 0.0 110.504 -170.976 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 37.8 ttt180 -137.54 134.73 36.01 Favored 'General case' 0 N--CA 1.479 0.998 0 C-N-CA 124.286 1.034 . . . . 0.0 109.605 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 8.2 ptm180 -138.52 175.75 9.29 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 123.325 0.65 . . . . 0.0 109.907 177.004 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 94.9 t -123.18 123.67 68.32 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.58 0 C-N-CA 124.268 1.027 . . . . 0.0 108.452 174.01 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 75.9 t -133.64 122.05 42.28 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.051 0 C-N-CA 123.766 0.826 . . . . 0.0 109.175 178.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 75.3 m-20 66.54 19.67 10.85 Favored 'General case' 0 N--CA 1.482 1.173 0 C-N-CA 124.928 1.291 . . . . 0.0 111.694 176.055 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 98.8 -19.74 53.11 Favored Glycine 0 C--N 1.345 1.051 0 CA-C-N 115.712 -0.676 . . . . 0.0 112.923 -177.085 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 3.7 ptpp? -81.66 166.28 20.29 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 122.831 0.453 . . . . 0.0 109.85 -178.637 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 45.8 t -114.42 110.55 32.47 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.772 0 C-N-CA 123.774 0.83 . . . . 0.0 108.911 -179.503 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 95.7 mt-10 -104.53 156.1 18.24 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 123.62 0.768 . . . . 0.0 110.475 -177.726 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.417 ' HD2' HG11 ' A' ' 8' ' ' VAL . 48.0 m-85 -134.9 124.06 24.4 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 124.391 1.077 . . . . 0.0 108.444 -179.763 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 32.7 t80 -76.72 107.68 9.2 Favored 'General case' 0 C--N 1.345 0.394 0 N-CA-C 108.053 -1.091 . . . . 0.0 108.053 178.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.577 HD11 HD22 ' A' ' 40' ' ' LEU . 43.0 mt -92.65 123.69 36.12 Favored 'General case' 0 C--N 1.326 -0.453 0 CA-C-N 115.191 -0.913 . . . . 0.0 110.344 -174.632 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.0 tmtp? -77.38 98.97 5.42 Favored 'General case' 0 N--CA 1.45 -0.46 0 N-CA-C 105.686 -1.968 . . . . 0.0 105.686 166.001 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.634 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 82.9 m95 -67.54 122.01 17.08 Favored 'General case' 0 N--CA 1.466 0.363 0 N-CA-C 109.128 -0.693 . . . . 0.0 109.128 173.84 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 32.3 ttpt -66.7 -26.99 67.28 Favored 'General case' 0 CA--C 1.54 0.578 0 O-C-N 123.643 0.589 . . . . 0.0 111.905 -175.399 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.28 -7.8 82.35 Favored Glycine 0 CA--C 1.533 1.177 0 CA-C-N 116.379 -0.373 . . . . 0.0 113.661 179.471 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 93.0 m-85 -129.44 162.84 27.16 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 123.593 0.757 . . . . 0.0 110.784 -174.069 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 81.8 p -73.14 161.63 30.38 Favored 'General case' 0 N--CA 1.472 0.649 0 C-N-CA 123.387 0.675 . . . . 0.0 110.861 179.476 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.483 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 21.0 m-20 -57.8 -36.39 72.14 Favored 'General case' 0 N--CA 1.479 0.991 0 O-C-N 123.576 0.547 . . . . 0.0 110.999 177.902 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -74.88 -18.0 60.5 Favored 'General case' 0 CA--C 1.549 0.94 0 C-N-CA 124.034 0.934 . . . . 0.0 112.542 -179.221 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 24.4 t70 -99.12 -8.1 25.69 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 122.408 0.283 . . . . 0.0 111.365 179.66 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.634 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.9 m120 -65.74 158.55 27.25 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 123.452 0.701 . . . . 0.0 112.584 -179.946 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 16.0 p -140.76 158.76 43.49 Favored 'General case' 0 N--CA 1.485 1.278 0 CA-C-O 121.403 0.621 . . . . 0.0 112.304 -173.494 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.0 m95 -80.67 123.24 28.0 Favored 'General case' 0 N--CA 1.472 0.636 0 C-N-CA 124.862 1.265 . . . . 0.0 109.828 173.525 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 62.3 mm-40 -123.3 133.41 24.52 Favored Pre-proline 0 N--CA 1.47 0.563 0 C-N-CA 122.849 0.46 . . . . 0.0 110.142 174.735 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 56.0 Cg_endo -66.98 156.97 63.92 Favored 'Trans proline' 0 C--N 1.371 1.747 0 C-N-CA 122.911 2.407 . . . . 0.0 112.12 177.475 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.401 ' HB3' ' HE1' ' A' ' 20' ' ' TYR . 0.0 OUTLIER -56.52 -31.32 63.99 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 123.852 0.861 . . . . 0.0 113.1 -176.779 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.66 -28.21 68.28 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.258 1.023 . . . . 0.0 111.736 179.429 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.441 ' OD1' ' HB3' ' B' ' 8' ' ' ARG . 57.0 t30 -89.47 -15.23 33.56 Favored 'General case' 0 CA--C 1.549 0.917 0 C-N-CA 124.463 1.105 . . . . 0.0 111.082 -176.002 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.577 HD22 HD11 ' A' ' 22' ' ' LEU . 28.5 mt -79.04 130.3 35.37 Favored 'General case' 0 N--CA 1.472 0.628 0 C-N-CA 123.099 0.56 . . . . 0.0 110.961 -173.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -105.6 12.53 31.1 Favored 'General case' 0 N--CA 1.475 0.805 0 C-N-CA 123.891 0.877 . . . . 0.0 109.763 175.314 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.5 p -113.16 90.3 16.07 Favored Pre-proline 0 CA--C 1.551 1.019 0 C-N-CA 124.234 1.014 . . . . 0.0 109.166 179.898 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 85.5 Cg_endo -81.51 -29.53 1.81 Allowed 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.607 2.205 . . . . 0.0 112.958 -177.147 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.92 -29.34 61.99 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 123.481 0.712 . . . . 0.0 111.122 178.919 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.427 ' HB3' HG23 ' A' ' 8' ' ' VAL . 32.6 mt -68.37 -30.09 68.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.528 0.331 . . . . 0.0 111.605 175.404 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.409 HD11 ' CD1' ' A' ' 40' ' ' LEU . 47.8 mm -71.71 -47.83 54.96 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 O-C-N 123.362 0.414 . . . . 0.0 110.343 176.405 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -54.96 -50.2 69.5 Favored 'General case' 0 N--CA 1.481 1.11 0 O-C-N 123.819 0.699 . . . . 0.0 110.386 174.756 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.36 -50.71 72.11 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 115.332 -0.849 . . . . 0.0 110.763 -179.453 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.418 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 73.3 t80 -55.85 -50.86 69.43 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.254 1.022 . . . . 0.0 111.756 -178.425 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.49 ' HA ' HE21 ' A' ' 53' ' ' GLN . 95.9 mt -64.43 -47.5 78.89 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.606 0.762 . . . . 0.0 111.128 -176.802 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 2.8 m-20 -66.16 -23.17 66.42 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.577 0.751 . . . . 0.0 111.524 179.328 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 67.3 m -87.46 -28.72 21.9 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 123.374 0.67 . . . . 0.0 112.482 -178.922 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.49 HE21 ' HA ' ' A' ' 50' ' ' LEU . 47.5 mt-30 -61.91 -33.21 73.83 Favored 'General case' 0 N--CA 1.489 1.481 0 C-N-CA 122.536 0.334 . . . . 0.0 111.048 179.376 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER . . . . . 0 CA--C 1.559 1.303 0 CA-C-O 117.741 -1.123 . . . . 0.0 109.751 -179.49 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.036 0 CA-C-O 120.809 0.338 . . . . 0.0 110.416 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.631 ' H ' ' HD3' ' B' ' 2' ' ' ARG . 0.0 OUTLIER -60.36 -22.04 62.81 Favored 'General case' 0 N--CA 1.484 1.246 0 C-N-CA 124.529 1.131 . . . . 0.0 112.025 174.788 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 3.1 p -65.77 105.06 1.18 Allowed 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 123.801 0.841 . . . . 0.0 110.588 173.623 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 68.4 mttm -96.41 144.21 26.75 Favored 'General case' 0 N--CA 1.473 0.678 0 C-N-CA 123.531 0.732 . . . . 0.0 110.93 179.466 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 21.3 mt-30 -80.6 75.92 7.47 Favored 'General case' 0 CA--C 1.543 0.682 0 N-CA-C 108.106 -1.072 . . . . 0.0 108.106 176.812 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 21.8 p -134.51 169.83 16.68 Favored 'General case' 0 N--CA 1.473 0.712 0 C-N-CA 123.75 0.82 . . . . 0.0 110.738 -170.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -168.26 165.39 13.04 Favored 'General case' 0 C--O 1.24 0.6 0 C-N-CA 123.864 0.866 . . . . 0.0 109.583 173.795 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.441 ' HB3' ' OD1' ' A' ' 39' ' ' ASN . 38.4 ttm-85 -96.33 178.72 5.28 Favored 'General case' 0 CA--C 1.544 0.726 0 N-CA-C 108.137 -1.061 . . . . 0.0 108.137 174.37 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.474 0.729 0 O-C-N 121.82 -0.55 . . . . 0.0 111.022 173.448 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 51.1 m -75.1 -32.02 61.31 Favored 'General case' 0 CA--C 1.541 0.612 0 N-CA-C 108.571 -0.899 . . . . 0.0 108.571 161.153 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 18.8 m -96.61 75.8 2.82 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 108.037 -1.097 . . . . 0.0 108.037 169.373 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -71.96 -14.58 76.02 Favored Glycine 0 C--N 1.348 1.237 0 CA-C-N 114.906 -1.043 . . . . 0.0 112.159 175.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 130.44 -41.62 1.51 Allowed Glycine 0 C--N 1.348 1.225 0 N-CA-C 111.644 -0.582 . . . . 0.0 111.644 176.4 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 23.5 ttmm -169.2 -50.23 0.02 OUTLIER 'General case' 0 N--CA 1.473 0.685 0 C-N-CA 123.671 0.788 . . . . 0.0 110.077 -176.412 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.249 1.048 0 CA-C-N 115.322 -0.854 . . . . 0.0 109.791 -179.158 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.79 0 N-CA-C 112.219 -0.352 . . . . 0.0 112.219 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 43.4 mt-10 -69.67 108.41 3.86 Favored 'General case' 0 C--O 1.244 0.805 0 C-N-CA 123.699 0.8 . . . . 0.0 109.956 178.735 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.44 ' HD2' ' HA ' ' B' ' 8' ' ' ARG . 67.4 m-85 -77.15 115.71 17.17 Favored 'General case' 0 C--O 1.244 0.775 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 178.851 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.5 p -79.29 115.54 21.76 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.617 0 CA-C-N 115.972 -0.558 . . . . 0.0 110.04 -177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.559 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 1.1 p -98.57 130.66 47.08 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.531 0 C-N-CA 124.212 1.005 . . . . 0.0 109.292 171.976 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 9.5 tp10 -60.83 -62.38 1.9 Allowed 'General case' 0 CA--C 1.541 0.609 0 C-N-CA 123.628 0.771 . . . . 0.0 109.912 173.427 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 5.2 ptpp? -165.71 168.88 15.75 Favored 'General case' 0 N--CA 1.472 0.668 0 CA-C-O 121.458 0.646 . . . . 0.0 110.943 178.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.405 HG13 ' HB3' ' A' ' 20' ' ' TYR . 77.8 t -74.1 136.23 25.76 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.582 0 CA-C-N 114.451 -1.25 . . . . 0.0 109.056 170.582 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 44.9 mt -103.0 -36.18 8.28 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.41 0.684 . . . . 0.0 110.201 179.108 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -156.12 162.74 40.2 Favored 'General case' 0 CA--C 1.541 0.598 0 CA-C-N 116.137 -0.483 . . . . 0.0 110.27 -173.887 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 36.0 ttt180 -124.13 143.94 50.19 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.573 1.149 . . . . 0.0 109.344 -177.991 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.0 ptm180 -137.78 164.76 28.11 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.728 0.811 . . . . 0.0 109.588 174.811 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.486 HG22 HG22 ' A' ' 18' ' ' VAL . 59.2 t -123.8 106.13 16.62 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.525 0 N-CA-C 107.695 -1.224 . . . . 0.0 107.695 169.186 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 91.3 t -85.62 102.92 11.98 Favored 'Isoleucine or valine' 0 C--O 1.24 0.598 0 N-CA-C 108.309 -0.997 . . . . 0.0 108.309 172.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.2 t-20 68.22 -76.08 0.06 Allowed 'General case' 0 CA--C 1.549 0.925 0 C-N-CA 125.257 1.423 . . . . 0.0 110.813 -179.196 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -139.51 -10.29 0.82 Allowed Glycine 0 N--CA 1.477 1.409 0 C-N-CA 123.401 0.524 . . . . 0.0 112.833 177.781 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.566 ' HD2' ' HB3' ' A' ' 36' ' ' PRO . 18.7 ttpt -95.83 146.08 24.84 Favored 'General case' 0 C--N 1.349 0.548 0 C-N-CA 124.978 1.311 . . . . 0.0 109.319 -179.208 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.486 HG22 HG22 ' A' ' 13' ' ' VAL . 85.9 t -98.5 129.35 48.93 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.688 0 C-N-CA 123.843 0.857 . . . . 0.0 109.822 177.587 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.438 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 33.9 mt-10 -121.07 148.05 44.69 Favored 'General case' 0 N--CA 1.472 0.673 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 172.842 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.405 ' HB3' HG13 ' A' ' 8' ' ' VAL . 88.5 m-85 -116.96 135.82 53.41 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 124.138 0.975 . . . . 0.0 109.551 -176.853 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 13.0 t80 -78.64 106.78 10.86 Favored 'General case' 0 N--CA 1.471 0.576 0 N-CA-C 108.199 -1.037 . . . . 0.0 108.199 179.493 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.525 HD11 HD22 ' A' ' 40' ' ' LEU . 27.0 mt -92.73 115.55 28.21 Favored 'General case' 0 C--N 1.321 -0.653 0 CA-C-N 116.111 -0.495 . . . . 0.0 110.57 -173.352 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 1.7 tmtp? -76.73 108.94 10.11 Favored 'General case' 0 C--O 1.221 -0.426 0 N-CA-C 106.337 -1.727 . . . . 0.0 106.337 166.112 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.559 ' HA ' ' HA ' ' A' ' 5' ' ' VAL . 81.4 m95 -75.17 123.44 25.26 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.444 0.465 . . . . 0.0 109.818 -179.935 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 88.7 tttt -63.76 -48.34 77.33 Favored 'General case' 0 CA--C 1.543 0.693 0 C-N-CA 123.946 0.898 . . . . 0.0 111.72 -173.736 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -85.06 2.5 88.25 Favored Glycine 0 C--N 1.344 1.025 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.292 -177.623 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.545 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 76.9 m-85 -128.69 171.18 12.44 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.965 0.906 . . . . 0.0 109.879 -176.509 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 82.2 p -80.55 166.12 21.46 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 112.55 0.574 . . . . 0.0 112.55 -174.288 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 11.2 m-20 -68.64 -27.95 66.46 Favored 'General case' 0 N--CA 1.475 0.813 0 CA-C-N 115.649 -0.705 . . . . 0.0 111.098 175.163 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -68.2 -16.66 64.07 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.585 0.754 . . . . 0.0 111.256 174.35 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 33.3 t70 -107.24 -1.29 21.94 Favored 'General case' 0 CA--C 1.556 1.201 0 C-N-CA 123.739 0.815 . . . . 0.0 111.208 -175.407 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 70.6 m-20 -58.81 126.33 27.2 Favored 'General case' 0 N--CA 1.493 1.683 0 C-N-CA 123.328 0.651 . . . . 0.0 111.351 175.502 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.4 p -129.06 150.63 50.37 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.049 0.54 . . . . 0.0 111.377 -174.831 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -76.94 118.25 19.33 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.792 0.837 . . . . 0.0 109.978 175.306 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 66.9 mm-40 -119.8 135.78 24.43 Favored Pre-proline 0 N--CA 1.471 0.593 0 C-N-CA 122.645 0.378 . . . . 0.0 110.249 175.786 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.566 ' HB3' ' HD2' ' A' ' 17' ' ' LYS . 37.1 Cg_endo -64.71 159.57 44.61 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 122.7 2.267 . . . . 0.0 113.667 -177.852 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 15.1 pt-20 -54.69 -37.2 65.51 Favored 'General case' 0 N--CA 1.478 0.937 0 C-N-CA 125.114 1.366 . . . . 0.0 111.858 -179.557 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.402 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 15.9 pt-20 -72.98 -22.14 60.74 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 124.836 1.254 . . . . 0.0 111.602 -177.379 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.413 ' HB2' ' HG2' ' A' ' 36' ' ' PRO . 50.2 t30 -90.79 -17.72 26.15 Favored 'General case' 0 C--O 1.243 0.722 0 C-N-CA 124.327 1.051 . . . . 0.0 110.825 -175.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.525 HD22 HD11 ' A' ' 22' ' ' LEU . 11.1 mt -76.84 129.88 36.85 Favored 'General case' 0 N--CA 1.468 0.475 0 CA-C-N 116.293 -0.412 . . . . 0.0 110.117 179.77 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 5.5 m-20 -104.82 17.67 23.7 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.35 -0.981 . . . . 0.0 108.35 170.047 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.416 ' SG ' ' HB3' ' A' ' 40' ' ' LEU . 10.8 p -116.71 90.03 30.28 Favored Pre-proline 0 CA--C 1.548 0.897 0 C-N-CA 124.601 1.16 . . . . 0.0 109.629 -175.728 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 90.8 Cg_endo -80.71 -27.49 3.19 Favored 'Trans proline' 0 C--N 1.373 1.851 0 C-N-CA 122.748 2.299 . . . . 0.0 112.857 -178.765 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -73.33 -27.79 61.71 Favored 'General case' 0 C--N 1.353 0.74 0 C-N-CA 123.39 0.676 . . . . 0.0 110.366 -179.954 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.491 HD21 ' HG2' ' B' ' 5' ' ' GLN . 34.5 mt -71.73 -40.01 69.72 Favored 'General case' 0 N--CA 1.478 0.959 0 O-C-N 123.268 0.355 . . . . 0.0 111.088 174.147 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 72.9 mt -63.51 -43.61 98.4 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.079 0 N-CA-C 109.956 -0.387 . . . . 0.0 109.956 178.058 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -65.87 -45.96 80.15 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 115.261 -0.881 . . . . 0.0 110.598 177.183 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -65.32 -31.8 73.12 Favored 'General case' 0 N--CA 1.478 0.969 0 CA-C-N 115.677 -0.692 . . . . 0.0 111.144 -176.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.402 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 68.6 t80 -62.1 -47.87 82.72 Favored 'General case' 0 N--CA 1.473 0.677 0 C-N-CA 123.638 0.775 . . . . 0.0 110.167 175.793 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 98.7 mt -62.34 -45.95 90.88 Favored 'General case' 0 N--CA 1.475 0.814 0 CA-C-N 115.739 -0.664 . . . . 0.0 110.3 179.107 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 78.0 m-20 -68.15 -24.88 65.04 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.386 0.674 . . . . 0.0 111.327 179.598 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t -75.42 -63.09 1.36 Allowed 'General case' 0 N--CA 1.476 0.827 0 C-N-CA 123.072 0.549 . . . . 0.0 110.664 -176.978 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.402 ' HG3' ' O ' ' A' ' 49' ' ' PHE . 3.6 pp0? -90.75 8.87 32.42 Favored 'General case' 0 N--CA 1.483 1.224 0 N-CA-C 112.586 0.588 . . . . 0.0 112.586 -171.88 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 75.6 mmtt . . . . . 0 N--CA 1.483 1.202 0 C-N-CA 124.269 1.028 . . . . 0.0 108.606 171.715 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.014 0 N-CA-C 109.682 -0.488 . . . . 0.0 109.682 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 93.8 mtt180 -80.81 -55.58 4.71 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.884 0.474 . . . . 0.0 110.223 178.328 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 20.8 p -71.12 96.79 1.4 Allowed 'General case' 0 CA--C 1.544 0.739 0 CA-C-O 121.251 0.548 . . . . 0.0 109.557 176.822 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 11.1 ptmm? -112.67 89.32 3.04 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.513 0.725 . . . . 0.0 110.688 -177.643 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.526 ' HB2' ' O ' ' A' ' 5' ' ' VAL . 0.8 OUTLIER -70.66 105.43 3.15 Favored 'General case' 0 N--CA 1.47 0.528 0 N-CA-C 107.414 -1.328 . . . . 0.0 107.414 174.354 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 4.2 t -85.77 138.67 31.92 Favored 'General case' 0 CA--C 1.547 0.85 0 CA-C-O 121.978 0.894 . . . . 0.0 112.577 -168.318 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -154.45 160.12 41.43 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 124.819 1.247 . . . . 0.0 108.166 170.192 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.44 ' HA ' ' HD2' ' A' ' 3' ' ' PHE . 0.1 OUTLIER -106.31 -174.21 2.48 Favored 'General case' 0 C--O 1.243 0.756 0 N-CA-C 108.811 -0.811 . . . . 0.0 108.811 174.092 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.475 0.813 0 C-N-CA 123.846 0.858 . . . . 0.0 109.012 174.302 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 71.1 p -67.69 88.39 0.24 Allowed 'General case' 0 CA--C 1.547 0.841 0 CA-C-O 121.748 0.785 . . . . 0.0 109.062 176.274 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 69.4 p -71.23 147.79 47.89 Favored 'General case' 0 C--O 1.244 0.778 0 CA-C-N 114.816 -1.084 . . . . 0.0 111.289 -175.357 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 93.21 -89.59 1.34 Allowed Glycine 0 C--N 1.34 0.78 0 N-CA-C 111.184 -0.767 . . . . 0.0 111.184 -177.347 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 58.83 -88.63 0.02 OUTLIER Glycine 0 C--N 1.353 1.49 0 O-C-N 124.195 0.585 . . . . 0.0 112.641 -178.34 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 62.5 tttp -166.99 76.2 0.17 Allowed 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 125.138 1.375 . . . . 0.0 107.535 176.479 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.551 1.006 0 C-N-CA 123.779 0.832 . . . . 0.0 109.932 -178.271 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.534 0 N-CA-C 112.113 -0.395 . . . . 0.0 112.113 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 -149.48 -73.2 0.18 Allowed 'General case' 0 N--CA 1.476 0.833 0 C-N-CA 123.568 0.747 . . . . 0.0 110.659 -178.681 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 98.5 m-85 -116.84 114.07 23.4 Favored 'General case' 0 N--CA 1.481 1.112 0 N-CA-C 109.165 -0.68 . . . . 0.0 109.165 175.705 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 7.1 p -85.49 134.68 26.58 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.628 0 CA-C-O 120.846 0.355 . . . . 0.0 110.063 -177.103 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.429 HG21 HD22 ' A' ' 22' ' ' LEU . 2.3 p -116.09 132.9 64.24 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.535 0 C-N-CA 123.935 0.894 . . . . 0.0 109.966 -179.552 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.4 tp10 -63.51 -57.73 9.27 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.388 1.075 . . . . 0.0 109.351 174.915 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 14.3 ptmm? -171.88 168.44 6.03 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 124.116 0.966 . . . . 0.0 111.031 -179.725 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.425 HG11 ' HD1' ' A' ' 20' ' ' TYR . 58.5 t -79.11 144.23 11.32 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.823 0 C-N-CA 123.591 0.756 . . . . 0.0 109.482 172.095 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 89.6 mt -108.45 -43.34 4.34 Favored 'General case' 0 N--CA 1.475 0.776 0 C-N-CA 124.286 1.034 . . . . 0.0 111.097 -179.393 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 28.4 t70 -150.65 164.75 35.32 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 123.171 0.589 . . . . 0.0 110.081 -175.567 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 77.7 ttt180 -129.74 144.52 51.33 Favored 'General case' 0 N--CA 1.477 0.916 0 C-N-CA 124.234 1.014 . . . . 0.0 110.145 -177.801 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 13.7 ptm180 -141.41 167.26 22.59 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 124.393 1.077 . . . . 0.0 109.953 176.235 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 49.1 t -126.4 108.26 18.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.723 0 N-CA-C 108.462 -0.94 . . . . 0.0 108.462 168.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 7.2 p -106.27 126.46 61.9 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.74 0 N-CA-C 108.916 -0.772 . . . . 0.0 108.916 -178.042 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 28.2 t-20 66.55 -71.7 0.09 Allowed 'General case' 0 N--CA 1.486 1.327 0 C-N-CA 125.004 1.321 . . . . 0.0 111.123 -174.065 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -164.85 15.96 0.1 OUTLIER Glycine 0 CA--C 1.523 0.565 0 CA-C-N 115.901 -0.59 . . . . 0.0 111.914 176.297 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 13.7 ptpt -118.33 159.42 23.43 Favored 'General case' 0 N--CA 1.483 1.176 0 C-N-CA 123.694 0.797 . . . . 0.0 109.711 -179.625 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 94.8 t -101.29 118.84 48.63 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.648 0 C-N-CA 123.237 0.615 . . . . 0.0 110.351 -179.25 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.713 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 38.8 mt-10 -104.88 161.25 14.35 Favored 'General case' 0 N--CA 1.48 1.047 0 CA-C-O 121.604 0.716 . . . . 0.0 111.885 169.819 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.425 ' HD1' HG11 ' A' ' 8' ' ' VAL . 97.0 m-85 -135.69 128.17 30.51 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 125.036 1.334 . . . . 0.0 108.793 -177.678 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 17.7 t80 -77.67 107.24 10.02 Favored 'General case' 0 N--CA 1.471 0.589 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.046 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.435 HD11 HD22 ' A' ' 40' ' ' LEU . 18.6 mt -91.17 122.38 33.76 Favored 'General case' 0 C--O 1.235 0.32 0 C-N-CA 122.38 0.272 . . . . 0.0 111.217 -172.528 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.3 tmtm? -77.26 103.36 7.15 Favored 'General case' 0 CA--C 1.536 0.406 0 N-CA-C 105.721 -1.955 . . . . 0.0 105.721 164.139 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.491 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 94.1 m95 -73.04 139.77 46.8 Favored 'General case' 0 C--O 1.239 0.545 0 C-N-CA 122.613 0.365 . . . . 0.0 110.497 -179.364 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 56.3 tttp -90.57 120.14 31.41 Favored 'General case' 0 CA--C 1.536 0.423 0 C-N-CA 123.556 0.742 . . . . 0.0 109.173 -175.77 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 98.28 -35.23 4.71 Favored Glycine 0 N--CA 1.472 1.1 0 N-CA-C 111.967 -0.453 . . . . 0.0 111.967 -175.952 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.491 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 65.2 m-85 -80.74 162.31 24.17 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.108 0.963 . . . . 0.0 109.851 173.566 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 59.4 p -82.38 173.09 12.36 Favored 'General case' 0 N--CA 1.478 0.967 0 C-N-CA 122.849 0.46 . . . . 0.0 110.923 177.399 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -71.21 -16.84 62.53 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 122.97 0.508 . . . . 0.0 111.686 177.072 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -73.86 -19.66 60.66 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.412 0.685 . . . . 0.0 111.107 173.618 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 45.6 m-20 -88.16 -19.1 27.4 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 123.328 0.651 . . . . 0.0 111.54 176.114 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 77.3 m-20 -52.76 121.72 7.76 Favored 'General case' 0 N--CA 1.485 1.313 0 O-C-N 123.718 0.636 . . . . 0.0 111.774 179.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.41 158.47 44.34 Favored 'General case' 0 N--CA 1.48 1.058 0 C-N-CA 123.83 0.852 . . . . 0.0 110.996 -172.859 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 97.6 m95 -82.48 109.74 16.98 Favored 'General case' 0 N--CA 1.472 0.658 0 C-N-CA 123.752 0.821 . . . . 0.0 110.63 -178.63 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.413 ' OE1' ' HA ' ' B' ' 9' ' ' M3L . 45.1 mm-40 -112.39 124.66 31.53 Favored Pre-proline 0 CA--C 1.539 0.529 0 N-CA-C 109.497 -0.557 . . . . 0.0 109.497 176.144 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.713 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 27.7 Cg_endo -63.18 161.94 28.39 Favored 'Trans proline' 0 C--N 1.365 1.405 0 C-N-CA 122.772 2.315 . . . . 0.0 112.589 175.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -53.45 -29.36 35.15 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.426 1.09 . . . . 0.0 112.42 178.672 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.474 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.5 pt-20 -67.2 -31.34 71.65 Favored 'General case' 0 CA--C 1.546 0.817 0 C-N-CA 124.068 0.947 . . . . 0.0 111.044 178.796 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.5 m-20 -80.31 -30.18 38.18 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 123.927 0.891 . . . . 0.0 111.114 178.624 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.435 HD22 HD11 ' A' ' 22' ' ' LEU . 13.5 mt -73.14 116.06 13.22 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 122.556 0.342 . . . . 0.0 110.325 -174.707 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 33.5 t70 -87.22 -7.57 57.77 Favored 'General case' 0 CA--C 1.551 0.981 0 N-CA-C 109.494 -0.558 . . . . 0.0 109.494 173.966 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.507 ' HB3' ' HB3' ' B' ' 5' ' ' GLN . 12.7 p -92.81 98.81 2.44 Favored Pre-proline 0 C--N 1.354 0.777 0 C-N-CA 125.034 1.334 . . . . 0.0 110.8 179.193 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.6 Cg_endo -76.36 -26.51 8.76 Favored 'Trans proline' 0 C--N 1.375 1.927 0 C-N-CA 122.21 1.94 . . . . 0.0 111.546 178.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -77.88 -30.3 50.74 Favored 'General case' 0 N--CA 1.469 0.488 0 C-N-CA 124.875 1.27 . . . . 0.0 111.606 -177.014 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 59.5 mt -77.16 -27.4 53.75 Favored 'General case' 0 N--CA 1.485 1.309 0 C-N-CA 122.522 0.329 . . . . 0.0 111.359 177.176 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.418 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 58.1 mt -68.2 -53.05 31.86 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.837 0 N-CA-C 108.639 -0.875 . . . . 0.0 108.639 172.13 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 39.0 tt0 -59.05 -51.89 68.09 Favored 'General case' 0 N--CA 1.474 0.761 0 CA-C-N 114.859 -1.064 . . . . 0.0 111.406 -177.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.37 -42.26 91.22 Favored 'General case' 0 N--CA 1.483 1.181 0 O-C-N 124.041 0.838 . . . . 0.0 111.362 -175.836 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.45 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 70.2 t80 -60.07 -48.37 82.01 Favored 'General case' 0 N--CA 1.476 0.828 0 C-N-CA 123.743 0.817 . . . . 0.0 110.942 175.984 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.418 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 72.9 mt -65.81 -25.9 67.44 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.35 0.66 . . . . 0.0 111.218 179.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 92.0 m-20 -80.44 -27.18 38.02 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.567 0.747 . . . . 0.0 111.592 176.776 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 25.3 m -69.52 -51.71 33.16 Favored 'General case' 0 N--CA 1.484 1.26 0 CA-C-O 121.457 0.646 . . . . 0.0 109.974 -179.135 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.45 ' HG2' ' O ' ' A' ' 49' ' ' PHE . 10.6 pt20 -79.66 -46.23 17.55 Favored 'General case' 0 CA--C 1.543 0.684 0 CA-C-N 114.561 -1.2 . . . . 0.0 111.186 -179.673 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 53.8 mtmt . . . . . 0 N--CA 1.482 1.144 0 C-N-CA 124.712 1.205 . . . . 0.0 111.062 -172.494 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.113 0 N-CA-C 110.062 -0.347 . . . . 0.0 110.062 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.3 ptp180 -158.24 63.07 0.45 Allowed 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.334 0.654 . . . . 0.0 110.265 179.275 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 27.3 m -79.25 69.96 5.55 Favored 'General case' 0 N--CA 1.477 0.909 0 CA-C-O 122.055 0.931 . . . . 0.0 109.428 174.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 35.1 mmtp -130.24 73.46 1.53 Allowed 'General case' 0 N--CA 1.47 0.561 0 N-CA-C 107.099 -1.445 . . . . 0.0 107.099 -178.596 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.507 ' HB3' ' HB3' ' A' ' 42' ' ' CYS . 5.8 tp60 -115.32 162.22 17.41 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 115.689 -0.687 . . . . 0.0 110.065 -173.532 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.406 ' H ' ' HG3' ' B' ' 5' ' ' GLN . 11.5 t -100.7 177.22 5.06 Favored 'General case' 0 C--O 1.249 1.028 0 CA-C-O 122.333 1.063 . . . . 0.0 111.341 -176.684 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -153.24 163.89 39.08 Favored 'General case' 0 C--O 1.247 0.969 0 C-N-CA 125.566 1.546 . . . . 0.0 107.785 176.522 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 62.2 ttt180 -114.52 161.52 17.92 Favored 'General case' 0 C--N 1.323 -0.569 0 C-N-CA 124.396 1.078 . . . . 0.0 108.47 -172.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.413 ' HA ' ' OE1' ' A' ' 35' ' ' GLU . . . . . . . . 0 N--CA 1.471 0.601 0 C-N-CA 123.024 0.53 . . . . 0.0 109.8 176.196 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 52.5 p -98.35 104.17 16.18 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 122.115 -0.366 . . . . 0.0 110.336 -172.417 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 10.0 t -67.3 -29.95 69.67 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.666 -0.697 . . . . 0.0 110.3 173.329 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -95.01 117.12 5.52 Favored Glycine 0 C--N 1.349 1.302 0 N-CA-C 110.407 -1.077 . . . . 0.0 110.407 170.526 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -88.57 57.63 4.14 Favored Glycine 0 C--N 1.348 1.214 0 C-N-CA 123.096 0.379 . . . . 0.0 112.937 -174.646 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 35.4 ttmt -149.18 116.97 6.25 Favored 'General case' 0 N--CA 1.476 0.826 0 C-N-CA 123.498 0.719 . . . . 0.0 109.294 176.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.251 1.154 0 C-N-CA 123.829 0.851 . . . . 0.0 109.212 -177.964 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.679 0 CA-C-O 119.977 -0.346 . . . . 0.0 112.291 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 31.6 tt0 -75.09 158.5 33.03 Favored 'General case' 0 C--O 1.244 0.769 0 N-CA-C 109.528 -0.545 . . . . 0.0 109.528 178.312 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 38.5 m-85 -77.12 113.43 14.85 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.294 -0.632 . . . . 0.0 109.294 -165.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 16.8 m -83.22 136.41 22.87 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 C-N-CA 122.74 0.416 . . . . 0.0 110.1 -178.569 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.457 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -117.25 129.68 73.37 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 C-N-CA 123.935 0.894 . . . . 0.0 110.185 179.94 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -70.37 -56.69 6.07 Favored 'General case' 0 C--O 1.241 0.656 0 C-N-CA 124.464 1.106 . . . . 0.0 110.616 179.888 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -155.07 161.16 41.38 Favored 'General case' 0 N--CA 1.479 0.983 0 CA-C-N 116.043 -0.526 . . . . 0.0 111.735 -178.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.402 HG23 ' HB3' ' A' ' 45' ' ' LEU . 61.7 t -88.29 136.14 23.97 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.672 0 CA-C-N 115.323 -0.853 . . . . 0.0 108.802 168.859 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.8 mt -102.8 -50.7 3.47 Favored 'General case' 0 CA--C 1.543 0.691 0 C-N-CA 124.455 1.102 . . . . 0.0 110.696 -174.602 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 16.6 t70 -150.75 168.09 25.45 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 123.283 0.633 . . . . 0.0 110.316 -169.822 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 23.6 ttt180 -134.2 142.81 47.53 Favored 'General case' 0 CA--C 1.553 1.087 0 C-N-CA 124.543 1.137 . . . . 0.0 111.36 -177.661 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 6.6 ptm180 -134.71 168.88 18.21 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 125.143 1.377 . . . . 0.0 108.756 175.397 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 80.6 t -126.92 110.78 23.86 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.43 0.692 . . . . 0.0 109.347 174.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 64.3 t -106.47 107.44 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.84 0 C-N-CA 124.381 1.072 . . . . 0.0 110.066 176.54 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 72.9 m-20 57.24 43.31 23.93 Favored 'General case' 0 N--CA 1.484 1.275 0 C-N-CA 124.77 1.228 . . . . 0.0 112.291 170.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 94.39 -25.2 23.84 Favored Glycine 0 C--N 1.346 1.119 0 CA-C-N 115.614 -0.721 . . . . 0.0 113.226 177.948 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 20.3 ttpt -91.24 151.45 20.92 Favored 'General case' 0 CA--C 1.54 0.591 0 C-N-CA 124.102 0.961 . . . . 0.0 109.727 179.037 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 98.8 t -98.03 138.31 23.1 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.695 0 C-N-CA 123.65 0.78 . . . . 0.0 109.743 177.589 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.608 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 34.2 mt-10 -121.28 166.48 13.96 Favored 'General case' 0 N--CA 1.471 0.624 0 N-CA-C 109.178 -0.675 . . . . 0.0 109.178 167.017 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 89.0 m-85 -137.1 152.52 50.1 Favored 'General case' 0 N--CA 1.471 0.597 0 C-N-CA 124.576 1.15 . . . . 0.0 108.836 -177.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 3.5 t80 -92.5 109.28 20.67 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 107.902 -1.147 . . . . 0.0 107.902 176.217 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.512 HD11 HD21 ' A' ' 40' ' ' LEU . 10.4 mp -92.05 116.52 29.0 Favored 'General case' 0 N--CA 1.468 0.446 0 C-N-CA 123.109 0.564 . . . . 0.0 110.844 -174.072 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 3.9 tmtm? -76.36 99.66 4.91 Favored 'General case' 0 CA--C 1.536 0.404 0 N-CA-C 105.695 -1.965 . . . . 0.0 105.695 165.738 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.655 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 94.2 m95 -70.16 135.17 48.87 Favored 'General case' 0 CA--C 1.538 0.496 0 O-C-N 123.421 0.451 . . . . 0.0 111.42 -179.114 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 33.1 ttpt -78.39 121.04 23.99 Favored 'General case' 0 CA--C 1.54 0.564 0 C-N-CA 124.533 1.133 . . . . 0.0 109.923 -176.413 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 85.78 0.0 87.81 Favored Glycine 0 CA--C 1.535 1.327 0 CA-C-N 116.158 -0.474 . . . . 0.0 113.312 -176.966 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.468 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 93.8 m-85 -118.6 152.45 36.01 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.993 0.917 . . . . 0.0 110.044 179.438 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 15.0 t -77.66 163.66 26.0 Favored 'General case' 0 CA--C 1.551 1.012 0 C-N-CA 123.401 0.68 . . . . 0.0 111.746 -173.699 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.425 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 m-20 -65.44 -31.69 72.91 Favored 'General case' 0 N--CA 1.488 1.428 0 C-N-CA 123.752 0.821 . . . . 0.0 111.992 -179.303 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -67.41 -18.75 65.23 Favored 'General case' 0 CA--C 1.551 1.006 0 C-N-CA 123.502 0.721 . . . . 0.0 111.79 177.083 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 26.3 t0 -108.56 -5.64 16.42 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 124.169 0.987 . . . . 0.0 111.177 -176.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.655 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.6 m120 -66.37 132.7 48.91 Favored 'General case' 0 N--CA 1.482 1.142 0 C-N-CA 122.582 0.353 . . . . 0.0 111.102 175.35 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 62.6 p -127.35 160.98 29.73 Favored 'General case' 0 N--CA 1.485 1.275 0 C-N-CA 123.46 0.704 . . . . 0.0 111.41 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 90.8 m95 -84.45 122.66 29.29 Favored 'General case' 0 C--O 1.243 0.723 0 CA-C-N 115.163 -0.926 . . . . 0.0 109.998 175.267 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 65.0 mm-40 -120.9 137.61 26.73 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 123.012 0.525 . . . . 0.0 110.61 175.642 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.608 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 32.2 Cg_endo -64.05 161.54 33.03 Favored 'Trans proline' 0 C--N 1.367 1.513 0 C-N-CA 122.397 2.065 . . . . 0.0 112.084 173.743 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -61.29 -24.32 66.33 Favored 'General case' 0 CA--C 1.552 1.052 0 CA-C-N 115.477 -0.783 . . . . 0.0 111.8 179.591 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.457 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 17.1 pt-20 -73.98 -22.44 59.62 Favored 'General case' 0 CA--C 1.553 1.088 0 C-N-CA 123.732 0.813 . . . . 0.0 111.441 178.653 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 4.9 m-20 -87.42 -15.94 36.3 Favored 'General case' 0 N--CA 1.486 1.361 0 C-N-CA 123.423 0.689 . . . . 0.0 111.372 177.089 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.512 HD21 HD11 ' A' ' 22' ' ' LEU . 62.5 mt -72.85 116.39 13.29 Favored 'General case' 0 N--CA 1.474 0.738 0 C-N-CA 122.595 0.358 . . . . 0.0 111.2 -176.572 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 28.8 t70 -101.29 6.81 42.98 Favored 'General case' 0 CA--C 1.555 1.156 0 N-CA-C 108.481 -0.933 . . . . 0.0 108.481 168.77 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 18.4 p -106.36 92.68 7.18 Favored Pre-proline 0 CA--C 1.555 1.139 0 C-N-CA 125.264 1.425 . . . . 0.0 110.147 -178.825 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 73.4 Cg_endo -78.48 -38.76 0.49 Allowed 'Trans proline' 0 C--N 1.376 1.995 0 C-N-CA 122.605 2.203 . . . . 0.0 113.599 -174.02 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -74.25 -21.21 59.87 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 122.815 0.446 . . . . 0.0 111.646 -175.564 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.419 ' HG ' ' OE1' ' B' ' 5' ' ' GLN . 74.0 mt -73.25 -30.22 63.31 Favored 'General case' 0 N--CA 1.482 1.133 0 C-N-CA 122.508 0.323 . . . . 0.0 111.275 174.758 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 46.4 mt -66.47 -46.53 86.32 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.961 0 N-CA-C 108.884 -0.784 . . . . 0.0 108.884 174.615 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 40.6 tt0 -62.86 -43.53 98.55 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 114.829 -1.078 . . . . 0.0 110.925 176.147 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.63 -32.42 73.74 Favored 'General case' 0 N--CA 1.479 1.024 0 C-N-CA 123.15 0.58 . . . . 0.0 110.915 -176.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 62.4 t80 -62.04 -43.57 98.56 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.059 0.944 . . . . 0.0 110.479 172.621 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.402 HD23 ' NE2' ' A' ' 53' ' ' GLN . 79.3 mt -71.18 -29.47 65.22 Favored 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.478 0.711 . . . . 0.0 110.291 178.116 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 87.5 m-20 -76.55 -15.97 59.73 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.751 0.82 . . . . 0.0 111.189 176.103 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 29.7 m -82.9 -12.6 57.24 Favored 'General case' 0 N--CA 1.478 0.963 0 C-N-CA 123.276 0.631 . . . . 0.0 110.393 172.799 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.402 ' NE2' HD23 ' A' ' 50' ' ' LEU . 70.5 mt-30 -93.13 -52.02 4.76 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.488 0.715 . . . . 0.0 109.541 176.963 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 61.9 mttm . . . . . 0 C--O 1.254 1.317 0 C-N-CA 125.071 1.349 . . . . 0.0 111.301 -176.833 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.999 0 N-CA-C 109.837 -0.431 . . . . 0.0 109.837 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 21.7 mmm180 -106.81 3.54 26.54 Favored 'General case' 0 N--CA 1.485 1.315 0 C-N-CA 123.558 0.743 . . . . 0.0 110.02 173.893 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 9.5 t -72.62 121.52 19.88 Favored 'General case' 0 CA--C 1.55 0.958 0 C-N-CA 123.9 0.88 . . . . 0.0 111.139 -173.352 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 17.2 tppt? -70.42 -36.37 73.97 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 124.058 0.943 . . . . 0.0 110.339 179.05 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.419 ' OE1' ' HG ' ' A' ' 45' ' ' LEU . 5.3 tp-100 59.59 84.77 0.11 Allowed 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.922 1.289 . . . . 0.0 110.568 175.322 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 0.2 OUTLIER -128.04 176.66 7.45 Favored 'General case' 0 CA--C 1.545 0.768 0 CA-C-N 115.557 -0.747 . . . . 0.0 111.456 -160.402 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -171.89 168.75 5.95 Favored 'General case' 0 C--O 1.241 0.655 0 C-N-CA 124.587 1.155 . . . . 0.0 109.473 176.566 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 73.5 ttt180 -111.29 148.25 33.31 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 124.145 0.978 . . . . 0.0 108.804 177.259 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.243 0.723 0 C-N-CA 122.904 0.482 . . . . 0.0 110.475 174.676 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 28.0 m -79.03 89.01 4.77 Favored 'General case' 0 CA--C 1.541 0.604 0 N-CA-C 106.213 -1.773 . . . . 0.0 106.213 169.458 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 25.9 p -66.29 102.2 0.82 Allowed 'General case' 0 CA--C 1.547 0.861 0 C-N-CA 123.867 0.867 . . . . 0.0 110.738 -175.059 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 70.37 27.18 73.08 Favored Glycine 0 C--N 1.348 1.236 0 CA-C-N 115.273 -0.876 . . . . 0.0 112.777 -173.168 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 78.83 5.91 88.59 Favored Glycine 0 CA--C 1.537 1.445 0 CA-C-O 119.88 -0.4 . . . . 0.0 113.565 -175.199 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 14.0 mmmm -122.87 150.57 42.71 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.511 0.724 . . . . 0.0 110.915 -177.094 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.55 0.974 0 CA-C-N 115.161 -0.927 . . . . 0.0 109.053 175.85 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . 0.557 ' HA2' HG21 ' B' ' 6' ' ' THR . . . . . . . . 0 N--CA 1.478 1.498 0 N-CA-C 112.276 -0.33 . . . . 0.0 112.276 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.54 ' HG3' ' HG3' ' B' ' 8' ' ' ARG . 1.6 pm0 -111.72 -86.12 0.56 Allowed 'General case' 0 CA--C 1.551 0.993 0 C-N-CA 123.5 0.72 . . . . 0.0 109.479 -177.596 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . 0.508 ' H ' ' HG2' ' A' ' 2' ' ' GLU . 37.8 m-85 -102.5 118.8 37.64 Favored 'General case' 0 N--CA 1.478 0.967 0 N-CA-C 107.793 -1.188 . . . . 0.0 107.793 176.286 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.513 ' HA ' HG22 ' B' ' 6' ' ' THR . 7.5 p -83.35 136.41 22.86 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.771 0 CA-C-O 121.306 0.574 . . . . 0.0 111.579 -173.526 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.47 HG21 HD22 ' A' ' 22' ' ' LEU . 1.5 p -118.02 126.84 75.18 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 124.253 1.021 . . . . 0.0 109.445 178.514 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 10.8 tp10 -59.25 -51.82 68.32 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.188 1.395 . . . . 0.0 111.514 174.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 18.1 ptpt -170.77 165.54 7.98 Favored 'General case' 0 N--CA 1.473 0.681 0 CA-C-N 115.697 -0.683 . . . . 0.0 110.73 -177.708 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.472 HG11 ' HD2' ' A' ' 20' ' ' TYR . 98.0 t -82.26 133.59 28.84 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.583 0 CA-C-N 115.176 -0.92 . . . . 0.0 108.596 168.206 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 91.9 mt -99.98 -38.47 8.58 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.468 0.707 . . . . 0.0 110.429 -178.394 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 33.4 t0 -153.62 163.6 39.7 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 122.85 0.46 . . . . 0.0 110.575 -174.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 45.0 ttt-85 -132.57 145.06 50.83 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.721 1.209 . . . . 0.0 109.329 -178.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 11.8 ptm180 -144.63 163.26 34.48 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 123.861 0.864 . . . . 0.0 109.655 176.15 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.471 HG22 HG22 ' A' ' 18' ' ' VAL . 88.3 t -122.23 109.49 24.44 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.894 0 C-N-CA 123.612 0.765 . . . . 0.0 108.941 175.375 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 98.2 t -113.54 115.24 49.15 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.95 0 C-N-CA 124.649 1.179 . . . . 0.0 109.701 177.788 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 93.8 m-20 64.73 27.71 13.07 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.839 1.256 . . . . 0.0 112.012 175.587 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 88.15 -11.82 66.24 Favored Glycine 0 N--CA 1.472 1.071 0 CA-C-N 116.026 -0.534 . . . . 0.0 113.121 -177.669 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 8.0 ttpt -86.3 146.42 26.51 Favored 'General case' 0 C--N 1.347 0.479 0 N-CA-C 107.78 -1.193 . . . . 0.0 107.78 175.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.471 HG22 HG22 ' A' ' 13' ' ' VAL . 98.4 t -107.16 121.92 60.65 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.809 0 C-N-CA 123.32 0.648 . . . . 0.0 109.453 179.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.511 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 48.5 mt-10 -112.84 155.91 23.82 Favored 'General case' 0 N--CA 1.471 0.612 0 C-N-CA 124.048 0.939 . . . . 0.0 109.597 177.757 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.472 ' HD2' HG11 ' A' ' 8' ' ' VAL . 96.4 m-85 -132.92 129.45 38.34 Favored 'General case' 0 N--CA 1.468 0.435 0 C-N-CA 124.469 1.108 . . . . 0.0 108.711 -178.368 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 36.9 t80 -76.88 107.76 9.44 Favored 'General case' 0 N--CA 1.466 0.337 0 N-CA-C 108.468 -0.938 . . . . 0.0 108.468 -179.762 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.47 HD22 HG21 ' A' ' 5' ' ' VAL . 16.6 mt -87.51 122.73 31.61 Favored 'General case' 0 C--O 1.24 0.583 0 CA-C-N 115.625 -0.716 . . . . 0.0 110.9 -175.036 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.0 tmtm? -76.24 93.17 3.36 Favored 'General case' 0 N--CA 1.448 -0.574 0 N-CA-C 106.496 -1.668 . . . . 0.0 106.496 165.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.56 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 85.6 m95 -65.22 117.61 8.05 Favored 'General case' 0 N--CA 1.473 0.686 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.137 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 39.0 ttpt -70.54 -43.46 69.49 Favored 'General case' 0 CA--C 1.541 0.633 0 C-N-CA 123.308 0.643 . . . . 0.0 110.798 -174.922 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -90.16 13.6 64.48 Favored Glycine 0 C--N 1.347 1.173 0 CA-C-N 115.895 -0.593 . . . . 0.0 113.784 -176.824 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 92.7 m-85 -136.78 161.69 35.28 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 124.159 0.984 . . . . 0.0 109.801 179.906 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 21.3 p -68.24 159.74 30.62 Favored 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.756 0.822 . . . . 0.0 111.795 -179.241 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 16.2 t70 -65.51 -38.27 89.19 Favored 'General case' 0 N--CA 1.47 0.55 0 CA-C-N 115.125 -0.943 . . . . 0.0 111.055 -174.512 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -64.66 -19.86 65.96 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.341 0.657 . . . . 0.0 111.877 177.159 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 32.8 t0 -96.43 -2.11 46.11 Favored 'General case' 0 CA--C 1.557 1.236 0 C-N-CA 123.933 0.893 . . . . 0.0 110.868 -178.733 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.56 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 1.5 m120 -64.94 129.08 38.42 Favored 'General case' 0 N--CA 1.491 1.587 0 C-N-CA 123.631 0.773 . . . . 0.0 110.394 172.5 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 24.3 p -138.64 158.72 43.72 Favored 'General case' 0 N--CA 1.487 1.406 0 C-N-CA 123.305 0.642 . . . . 0.0 112.01 -169.564 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 91.4 m95 -80.79 121.07 25.47 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 124.636 1.174 . . . . 0.0 111.147 177.927 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.487 ' HB2' HD21 ' A' ' 40' ' ' LEU . 49.3 mm-40 -122.59 134.01 24.72 Favored Pre-proline 0 N--CA 1.477 0.884 0 C-N-CA 123.425 0.69 . . . . 0.0 110.552 178.988 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.511 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 69.7 Cg_endo -70.6 154.86 64.15 Favored 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.778 2.319 . . . . 0.0 111.813 179.764 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -57.29 -28.39 62.98 Favored 'General case' 0 N--CA 1.486 1.374 0 C-N-CA 124.407 1.083 . . . . 0.0 113.31 -175.327 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -67.92 -37.71 82.0 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.066 0.946 . . . . 0.0 110.552 178.677 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.409 HD22 ' HB3' ' A' ' 35' ' ' GLU . 41.8 t30 -77.58 -23.21 50.02 Favored 'General case' 0 C--O 1.242 0.71 0 C-N-CA 125.195 1.398 . . . . 0.0 110.604 -178.027 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.487 HD21 ' HB2' ' A' ' 35' ' ' GLU . 57.6 mt -75.02 137.41 41.49 Favored 'General case' 0 N--CA 1.469 0.507 0 CA-C-N 115.556 -0.747 . . . . 0.0 110.939 -178.456 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 21.9 t70 -111.68 11.26 21.06 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.909 0.883 . . . . 0.0 109.643 176.784 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 20.2 p -115.54 90.96 27.52 Favored Pre-proline 0 CA--C 1.552 1.03 0 C-N-CA 123.813 0.845 . . . . 0.0 111.059 -175.292 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 71.4 Cg_endo -74.31 -24.72 14.1 Favored 'Trans proline' 0 C--N 1.377 2.033 0 C-N-CA 122.615 2.21 . . . . 0.0 111.897 172.273 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 10.0 tp10 -56.84 -52.74 63.9 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 124.779 1.232 . . . . 0.0 110.926 176.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 75.5 mt -69.16 -33.68 73.78 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 115.24 -0.891 . . . . 0.0 112.144 -175.477 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.409 HD11 HD13 ' A' ' 40' ' ' LEU . 47.7 mm -68.4 -46.68 80.19 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 122.759 0.424 . . . . 0.0 110.391 178.422 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 10.3 tp10 -57.9 -53.96 52.26 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.825 0.85 . . . . 0.0 110.522 178.321 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -59.57 -46.69 88.17 Favored 'General case' 0 N--CA 1.47 0.57 0 CA-C-N 114.454 -1.248 . . . . 0.0 111.835 -177.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 58.2 t80 -61.99 -52.41 64.11 Favored 'General case' 0 N--CA 1.482 1.138 0 C-N-CA 124.067 0.947 . . . . 0.0 111.93 -178.061 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.444 HD23 ' NE2' ' A' ' 53' ' ' GLN . 96.7 mt -61.15 -33.6 73.66 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.435 0.694 . . . . 0.0 111.181 -177.634 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . 0.402 ' HA ' ' NZ ' ' A' ' 54' ' ' LYS . 95.4 m-20 -75.38 -37.77 60.35 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 123.428 0.691 . . . . 0.0 111.491 177.779 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 61.8 m -70.22 -15.39 62.92 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.752 0.821 . . . . 0.0 112.234 -178.867 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.444 ' NE2' HD23 ' A' ' 50' ' ' LEU . 78.1 mt-30 -67.14 -28.22 67.95 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 123.073 0.549 . . . . 0.0 111.292 174.473 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.402 ' NZ ' ' HA ' ' A' ' 51' ' ' ASN . 34.2 mtmm . . . . . 0 C--O 1.249 1.06 0 N-CA-C 108.554 -0.906 . . . . 0.0 108.554 174.713 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.487 1.413 0 CA-C-O 120.877 0.37 . . . . 0.0 110.102 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 69.2 mtm180 -79.11 83.4 5.19 Favored 'General case' 0 CA--C 1.543 0.687 0 CA-C-N 115.533 -0.758 . . . . 0.0 109.675 179.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 22.1 p -109.13 119.02 38.27 Favored 'General case' 0 CA--C 1.539 0.525 0 C-N-CA 124.141 0.976 . . . . 0.0 109.564 -177.445 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 45.9 mtmt -83.88 71.07 10.5 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.743 0.817 . . . . 0.0 109.591 178.066 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 12.6 pt20 -100.5 84.64 2.8 Favored 'General case' 0 CA--C 1.538 0.487 0 CA-C-O 122.068 0.937 . . . . 0.0 110.43 -174.747 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.557 HG21 ' HA2' ' A' ' 1' ' ' GLY . 40.8 p -134.01 175.18 9.71 Favored 'General case' 0 C--O 1.242 0.706 0 C-N-CA 124.817 1.247 . . . . 0.0 110.135 -177.633 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -167.21 161.37 14.44 Favored 'General case' 0 N--CA 1.476 0.849 0 C-N-CA 124.633 1.173 . . . . 0.0 109.964 177.798 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.564 ' HD2' ' H ' ' B' ' 8' ' ' ARG . 0.1 OUTLIER -90.99 -164.95 1.25 Allowed 'General case' 0 N--CA 1.484 1.272 0 N-CA-C 107.831 -1.174 . . . . 0.0 107.831 174.351 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.402 HM13 ' HD2' ' B' ' 9' ' ' M3L . . . . . . . . 0 N--CA 1.48 1.033 0 O-C-N 121.669 -0.644 . . . . 0.0 111.959 178.543 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 23.5 t 72.06 -63.01 0.44 Allowed 'General case' 0 N--CA 1.476 0.829 0 C-N-CA 126.603 1.961 . . . . 0.0 110.854 178.803 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 62.5 p -75.96 78.41 2.84 Favored 'General case' 0 CA--C 1.555 1.151 0 C-N-CA 125.201 1.4 . . . . 0.0 110.741 176.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -75.61 -34.67 48.79 Favored Glycine 0 C--N 1.343 0.938 0 CA-C-N 115.054 -0.975 . . . . 0.0 111.76 173.275 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -136.43 -170.06 11.89 Favored Glycine 0 C--N 1.347 1.188 0 N-CA-C 111.376 -0.69 . . . . 0.0 111.376 172.398 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 22.7 tptm -142.0 132.5 25.27 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 123.513 0.725 . . . . 0.0 109.777 178.658 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.248 1.018 0 C-N-CA 124.284 1.034 . . . . 0.0 108.338 176.668 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.922 0 N-CA-C 112.585 -0.206 . . . . 0.0 112.585 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . 0.444 ' HG3' ' HD3' ' B' ' 8' ' ' ARG . 3.8 mp0 -90.18 131.53 35.97 Favored 'General case' 0 C--O 1.241 0.625 0 N-CA-C 108.044 -1.095 . . . . 0.0 108.044 177.146 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -124.54 156.31 37.57 Favored 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.124 0.569 . . . . 0.0 109.669 -178.935 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.617 HG21 ' HB2' ' B' ' 4' ' ' LYS . 4.2 p -69.72 126.92 30.8 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.856 0 CA-C-O 121.353 0.597 . . . . 0.0 112.284 -179.991 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.472 HG21 HD22 ' A' ' 22' ' ' LEU . 2.1 p -99.84 120.14 48.84 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.778 0 N-CA-C 109.318 -0.623 . . . . 0.0 109.318 170.483 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 35.5 tt0 -53.27 -57.96 8.74 Favored 'General case' 0 N--CA 1.477 0.899 0 C-N-CA 125.733 1.613 . . . . 0.0 111.726 174.054 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 8.1 ptpp? -162.52 161.88 27.16 Favored 'General case' 0 N--CA 1.479 1.025 0 CA-C-N 115.291 -0.868 . . . . 0.0 110.52 -174.902 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . . . . . . . . . 89.5 t -85.49 130.65 35.93 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.807 0 N-CA-C 108.585 -0.895 . . . . 0.0 108.585 168.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 92.7 mt -96.91 -38.54 9.78 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.887 0.875 . . . . 0.0 111.282 -177.635 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 25.9 t0 -156.24 164.33 38.48 Favored 'General case' 0 N--CA 1.481 1.094 0 CA-C-N 116.64 -0.255 . . . . 0.0 111.117 -169.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.568 ' HE ' HG11 ' A' ' 18' ' ' VAL . 41.8 ttt180 -134.94 144.33 47.39 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.975 0.91 . . . . 0.0 110.577 -173.375 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 9.4 ptm180 -140.49 163.62 32.34 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 123.791 0.836 . . . . 0.0 109.798 176.617 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . 0.441 HG22 HG22 ' A' ' 18' ' ' VAL . 89.2 t -121.7 123.93 70.47 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.889 0 N-CA-C 108.695 -0.854 . . . . 0.0 108.695 170.019 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . 0.444 ' O ' ' HG2' ' A' ' 17' ' ' LYS . 2.6 p -139.21 123.25 19.64 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 C-N-CA 124.032 0.933 . . . . 0.0 108.884 -177.863 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 3.2 m-20 60.77 22.49 12.48 Favored 'General case' 0 N--CA 1.492 1.626 0 C-N-CA 124.276 1.03 . . . . 0.0 112.455 179.03 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.31 -8.15 77.61 Favored Glycine 0 CA--C 1.529 0.95 0 CA-C-O 119.878 -0.401 . . . . 0.0 113.994 179.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.444 ' HG2' ' O ' ' A' ' 14' ' ' VAL . 15.0 ptpt -94.93 171.58 8.68 Favored 'General case' 0 N--CA 1.479 0.999 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 174.595 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.568 HG11 ' HE ' ' A' ' 11' ' ' ARG . 99.1 t -117.69 126.3 74.66 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.473 0 N-CA-C 108.718 -0.845 . . . . 0.0 108.718 174.89 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.581 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 36.7 mt-10 -106.82 157.09 18.01 Favored 'General case' 0 N--CA 1.474 0.725 0 CA-C-O 121.576 0.703 . . . . 0.0 109.721 169.336 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.3 m-85 -126.61 127.44 45.23 Favored 'General case' 0 C--O 1.238 0.48 0 CA-C-N 114.859 -1.064 . . . . 0.0 108.441 -179.04 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 66.7 t80 -77.06 108.85 10.43 Favored 'General case' 0 C--N 1.347 0.464 0 N-CA-C 106.794 -1.558 . . . . 0.0 106.794 174.241 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.472 HD22 HG21 ' A' ' 5' ' ' VAL . 49.8 mt -81.78 172.79 12.95 Favored 'General case' 0 C--N 1.325 -0.46 0 O-C-N 124.061 0.851 . . . . 0.0 111.102 -174.648 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 2.8 tmtp? -126.46 100.97 6.48 Favored 'General case' 0 C--O 1.218 -0.562 0 N-CA-C 106.356 -1.72 . . . . 0.0 106.356 168.552 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.531 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 84.6 m95 -69.57 116.63 10.19 Favored 'General case' 0 N--CA 1.469 0.52 0 N-CA-C 109.065 -0.717 . . . . 0.0 109.065 176.754 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 27.1 ttpp -73.1 114.32 11.14 Favored 'General case' 0 CA--C 1.537 0.448 0 O-C-N 123.778 0.674 . . . . 0.0 110.173 -171.599 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 118.13 -29.26 6.56 Favored Glycine 0 N--CA 1.47 0.928 0 N-CA-C 111.328 -0.709 . . . . 0.0 111.328 -174.17 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 95.9 m-85 -98.05 157.81 15.91 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.214 1.005 . . . . 0.0 111.256 179.084 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . 0.404 HG23 ' H ' ' A' ' 31' ' ' ASP . 9.1 t -74.26 160.77 30.66 Favored 'General case' 0 N--CA 1.472 0.641 0 CA-C-N 115.257 -0.883 . . . . 0.0 110.598 178.714 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.475 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 8.7 m-20 -70.0 -19.04 63.35 Favored 'General case' 0 N--CA 1.476 0.832 0 CA-C-N 115.973 -0.558 . . . . 0.0 111.147 -178.682 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.02 -31.54 66.29 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.868 0.867 . . . . 0.0 110.578 173.308 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.404 ' H ' HG23 ' A' ' 28' ' ' THR . 27.7 t70 -78.79 -30.7 45.65 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.366 0.666 . . . . 0.0 110.978 -178.95 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.531 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 10.0 m120 -61.46 148.75 40.83 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 123.846 0.716 . . . . 0.0 112.423 -172.746 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 45.3 p -126.57 163.8 22.61 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.772 0.829 . . . . 0.0 111.286 -167.779 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.1 m95 -84.3 119.73 25.41 Favored 'General case' 0 C--O 1.243 0.733 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 170.632 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.5 mm-40 -119.56 132.71 23.92 Favored Pre-proline 0 C--O 1.239 0.511 0 N-CA-C 109.191 -0.67 . . . . 0.0 109.191 172.125 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.581 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 48.2 Cg_endo -67.11 160.0 49.46 Favored 'Trans proline' 0 C--N 1.366 1.455 0 C-N-CA 122.161 1.907 . . . . 0.0 112.333 179.153 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 16.3 pt-20 -55.69 -28.22 54.38 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 125.025 1.33 . . . . 0.0 112.204 178.924 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.473 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 11.0 pt-20 -75.5 -17.72 60.03 Favored 'General case' 0 CA--C 1.551 0.983 0 C-N-CA 125.056 1.342 . . . . 0.0 111.731 -178.587 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 52.2 t30 -107.97 -4.77 17.57 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.199 0.599 . . . . 0.0 111.331 -169.636 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.567 HD12 HD11 ' A' ' 46' ' ' ILE . 30.7 mt -87.05 158.2 19.27 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.15 0.58 . . . . 0.0 110.861 -177.49 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 27.2 m-20 -109.54 9.76 25.23 Favored 'General case' 0 N--CA 1.487 1.393 0 N-CA-C 109.652 -0.499 . . . . 0.0 109.652 166.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 23.0 p -117.43 90.61 35.28 Favored Pre-proline 0 CA--C 1.546 0.807 0 C-N-CA 123.069 0.548 . . . . 0.0 111.527 -172.663 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -77.75 -22.14 10.63 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.314 2.01 . . . . 0.0 111.079 166.319 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -66.28 -44.31 83.91 Favored 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 124.246 1.018 . . . . 0.0 111.593 177.556 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 93.3 mt -76.81 -29.18 55.87 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 122.982 0.513 . . . . 0.0 110.963 -178.051 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.567 HD11 HD12 ' A' ' 40' ' ' LEU . 72.0 mt -63.48 -54.28 34.63 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.16 0 N-CA-C 109.384 -0.599 . . . . 0.0 109.384 172.088 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 35.8 tt0 -62.51 -46.14 89.78 Favored 'General case' 0 N--CA 1.474 0.732 0 CA-C-N 115.515 -0.766 . . . . 0.0 110.692 -176.843 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -63.7 -38.2 90.2 Favored 'General case' 0 N--CA 1.481 1.122 0 O-C-N 123.747 0.655 . . . . 0.0 110.766 -177.974 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.45 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 82.8 t80 -58.78 -48.5 81.04 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.044 0.538 . . . . 0.0 109.952 173.121 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 92.3 mt -65.56 -27.6 68.55 Favored 'General case' 0 N--CA 1.479 0.975 0 C-N-CA 123.498 0.719 . . . . 0.0 111.557 -179.604 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 48.5 m-80 -82.5 -19.64 38.35 Favored 'General case' 0 N--CA 1.481 1.119 0 C-N-CA 123.582 0.753 . . . . 0.0 111.981 175.412 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 53.5 m -83.07 -55.06 4.59 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 122.691 0.396 . . . . 0.0 110.321 177.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.45 ' HG3' ' O ' ' A' ' 49' ' ' PHE . 1.3 pp0? -78.15 -24.1 47.44 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 122.68 0.392 . . . . 0.0 111.806 -179.407 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 31.1 mtmm . . . . . 0 N--CA 1.484 1.272 0 C-N-CA 124.599 1.16 . . . . 0.0 111.817 175.235 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.488 1.446 0 CA-C-O 121.043 0.449 . . . . 0.0 109.951 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.1 ptt180 -139.45 109.35 6.35 Favored 'General case' 0 CA--C 1.546 0.82 0 C-N-CA 123.562 0.745 . . . . 0.0 109.466 177.598 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 12.2 p -113.44 135.82 53.45 Favored 'General case' 0 C--O 1.243 0.717 0 C-N-CA 123.574 0.749 . . . . 0.0 109.967 176.307 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . 0.617 ' HB2' HG21 ' A' ' 4' ' ' VAL . 21.4 pttm -103.62 80.67 1.81 Allowed 'General case' 0 CA--C 1.541 0.618 0 CA-C-O 122.031 0.919 . . . . 0.0 108.612 174.674 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 6.5 tp-100 -78.99 145.36 33.97 Favored 'General case' 0 CA--C 1.544 0.717 0 CA-C-N 114.975 -1.011 . . . . 0.0 110.789 -175.189 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 76.1 p -99.33 177.71 5.11 Favored 'General case' 0 C--O 1.246 0.878 0 CA-C-O 122.016 0.912 . . . . 0.0 112.532 -171.828 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -163.84 156.36 17.64 Favored 'General case' 0 C--O 1.241 0.624 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.267 174.177 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.444 ' HD3' ' HG3' ' A' ' 2' ' ' GLU . 14.1 tpt180 -97.41 146.15 25.48 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.249 0.62 . . . . 0.0 109.673 179.779 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.538 0.513 0 C-N-CA 123.153 0.581 . . . . 0.0 109.858 169.738 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 36.9 t -56.0 93.31 0.01 OUTLIER 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.957 0.903 . . . . 0.0 110.904 -178.066 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 2.9 t -74.17 84.5 1.85 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 124.498 1.119 . . . . 0.0 111.005 -173.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 70.02 -86.03 0.3 Allowed Glycine 0 C--N 1.345 1.054 0 CA-C-N 115.01 -0.995 . . . . 0.0 112.727 178.619 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 77.06 -67.02 2.78 Favored Glycine 0 C--N 1.354 1.528 0 N-CA-C 110.383 -1.087 . . . . 0.0 110.383 -171.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 36.5 ttpt -158.06 93.36 1.24 Allowed 'General case' 0 CA--C 1.536 0.43 0 N-CA-C 106.508 -1.664 . . . . 0.0 106.508 169.703 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.116 0 C-N-CA 123.842 0.857 . . . . 0.0 109.465 -172.914 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 1.469 0 N-CA-C 111.799 -0.521 . . . . 0.0 111.799 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 2.5 mp0 -90.25 94.34 9.72 Favored 'General case' 0 C--O 1.24 0.561 0 N-CA-C 108.39 -0.967 . . . . 0.0 108.39 177.332 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 76.6 m-85 -93.98 157.73 15.96 Favored 'General case' 0 C--O 1.239 0.509 0 CA-C-N 115.681 -0.69 . . . . 0.0 109.871 -177.798 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.4 p -80.53 123.82 37.68 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.665 0 CA-C-O 121.468 0.651 . . . . 0.0 109.562 177.817 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.513 ' HA ' ' HA ' ' A' ' 24' ' ' TRP . 2.0 p -102.97 133.45 46.74 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.509 0 C-N-CA 124.412 1.085 . . . . 0.0 109.358 175.547 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.622 ' HB2' ' HG3' ' A' ' 25' ' ' LYS . 34.3 tt0 -69.55 -49.15 57.02 Favored 'General case' 0 C--O 1.241 0.646 0 C-N-CA 123.474 0.71 . . . . 0.0 111.01 176.585 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . 0.478 ' HA ' HD22 ' A' ' 45' ' ' LEU . 21.1 ptmt -166.61 164.92 16.93 Favored 'General case' 0 N--CA 1.476 0.873 0 O-C-N 123.633 0.583 . . . . 0.0 111.607 -173.937 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.537 HG11 ' HD2' ' A' ' 20' ' ' TYR . 94.7 t -85.51 135.76 24.25 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.604 0 N-CA-C 108.331 -0.988 . . . . 0.0 108.331 166.475 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 85.0 mt -100.48 -43.64 6.15 Favored 'General case' 0 N--CA 1.471 0.583 0 C-N-CA 123.736 0.814 . . . . 0.0 110.137 178.539 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.2 t70 -148.92 164.86 33.3 Favored 'General case' 0 N--CA 1.47 0.542 0 CA-C-N 116.239 -0.437 . . . . 0.0 110.343 -171.076 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.507 ' HE ' HG11 ' A' ' 18' ' ' VAL . 34.9 ttt180 -138.72 128.59 25.12 Favored 'General case' 0 CA--C 1.538 0.512 0 C-N-CA 124.068 0.947 . . . . 0.0 109.485 -175.878 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . 0.402 HH11 ' HD3' ' A' ' 12' ' ' ARG . 3.0 ptm180 -124.41 162.31 24.15 Favored 'General case' 0 N--CA 1.48 1.051 0 C-N-CA 123.934 0.894 . . . . 0.0 109.35 175.987 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 59.4 t -126.31 112.45 29.89 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 123.966 0.906 . . . . 0.0 108.768 177.63 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 10.0 m -120.45 125.2 73.89 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.402 0 C-N-CA 124.113 0.965 . . . . 0.0 109.401 179.579 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 33.0 m-80 61.61 20.84 11.63 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.226 1.01 . . . . 0.0 112.108 177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 96.8 -24.04 32.76 Favored Glycine 0 C--N 1.348 1.211 0 CA-C-N 116.076 -0.511 . . . . 0.0 113.448 -176.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 10.8 ptmt -82.54 163.35 21.58 Favored 'General case' 0 N--CA 1.479 1.024 0 N-CA-C 108.566 -0.902 . . . . 0.0 108.566 179.208 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.507 HG11 ' HE ' ' A' ' 11' ' ' ARG . 45.9 t -117.6 127.11 75.04 Favored 'Isoleucine or valine' 0 CA--C 1.54 0.567 0 C-N-CA 123.312 0.645 . . . . 0.0 110.186 -176.382 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.569 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 45.1 mt-10 -109.19 154.05 22.92 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.599 0.76 . . . . 0.0 109.586 170.504 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.537 ' HD2' HG11 ' A' ' 8' ' ' VAL . 63.8 m-85 -128.04 128.51 45.08 Favored 'General case' 0 N--CA 1.469 0.513 0 C-N-CA 124.435 1.094 . . . . 0.0 108.669 -178.742 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 37.1 t80 -78.51 107.89 11.49 Favored 'General case' 0 N--CA 1.472 0.646 0 N-CA-C 108.336 -0.987 . . . . 0.0 108.336 177.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . . . . . . . . . 60.2 mt -92.84 119.86 32.61 Favored 'General case' 0 C--N 1.325 -0.482 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.345 -171.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtt? -75.87 93.33 3.18 Favored 'General case' 0 C--N 1.345 0.404 0 N-CA-C 106.887 -1.523 . . . . 0.0 106.887 167.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.626 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 87.1 m95 -68.51 134.79 50.6 Favored 'General case' 0 C--O 1.24 0.582 0 CA-C-N 116.168 -0.469 . . . . 0.0 110.576 178.483 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.622 ' HG3' ' HB2' ' A' ' 6' ' ' GLU . 26.4 mttm -67.64 134.23 50.79 Favored 'General case' 0 N--CA 1.466 0.326 0 O-C-N 123.863 0.727 . . . . 0.0 110.19 172.537 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 89.19 -33.95 4.12 Favored Glycine 0 CA--C 1.534 1.268 0 CA-C-N 115.254 -0.885 . . . . 0.0 112.842 178.708 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.427 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 79.7 m-85 -91.43 149.48 21.69 Favored 'General case' 0 N--CA 1.476 0.841 0 C-N-CA 124.048 0.939 . . . . 0.0 110.509 -177.146 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 18.2 p -70.54 160.98 31.47 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.934 0.894 . . . . 0.0 111.795 -179.626 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . 0.472 ' HA ' ' OD1' ' A' ' 32' ' ' ASN . 6.9 p-10 -65.54 -29.94 70.62 Favored 'General case' 0 N--CA 1.48 1.071 0 C-N-CA 124.341 1.057 . . . . 0.0 111.872 -177.406 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -75.8 -27.02 57.78 Favored 'General case' 0 CA--C 1.551 0.998 0 C-N-CA 123.541 0.736 . . . . 0.0 111.19 175.889 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 30.8 t70 -89.04 -11.96 42.67 Favored 'General case' 0 N--CA 1.478 0.968 0 C-N-CA 123.65 0.78 . . . . 0.0 110.83 178.962 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.626 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -64.26 143.07 58.16 Favored 'General case' 0 C--N 1.354 0.787 0 C-N-CA 122.529 0.332 . . . . 0.0 110.479 174.668 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 34.2 p -132.94 160.85 35.87 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 123.191 0.596 . . . . 0.0 111.876 -168.427 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 95.8 m95 -82.24 122.23 27.65 Favored 'General case' 0 N--CA 1.472 0.642 0 CA-C-N 114.967 -1.015 . . . . 0.0 109.78 173.873 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 64.0 mm-40 -121.08 130.18 24.96 Favored Pre-proline 0 C--O 1.239 0.533 0 N-CA-C 109.76 -0.459 . . . . 0.0 109.76 171.989 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.569 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 23.6 Cg_endo -61.22 162.04 21.19 Favored 'Trans proline' 0 C--N 1.371 1.758 0 C-N-CA 122.339 2.026 . . . . 0.0 112.31 176.508 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -55.02 -26.32 36.42 Favored 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 125.555 1.542 . . . . 0.0 113.153 -177.687 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -77.65 -28.22 51.2 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 124.825 1.25 . . . . 0.0 111.989 -179.621 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.422 ' HB3' ' O ' ' B' ' 8' ' ' ARG . 4.6 m-20 -77.63 -21.87 51.62 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.525 0.73 . . . . 0.0 111.517 178.983 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 44.0 mt -73.28 117.48 15.07 Favored 'General case' 0 N--CA 1.47 0.562 0 C-N-CA 122.886 0.474 . . . . 0.0 110.412 -176.624 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 7.7 m-20 -94.78 -3.84 48.34 Favored 'General case' 0 N--CA 1.48 1.074 0 C-N-CA 123.391 0.676 . . . . 0.0 110.204 172.382 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 16.3 p -101.01 98.0 7.91 Favored Pre-proline 0 CA--C 1.551 1.009 0 C-N-CA 124.618 1.167 . . . . 0.0 110.893 -176.08 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 92.3 Cg_endo -76.22 -25.19 10.27 Favored 'Trans proline' 0 C--N 1.383 2.382 0 C-N-CA 122.623 2.215 . . . . 0.0 112.191 179.296 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 13.2 tp10 -59.3 -47.99 83.31 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 124.549 1.14 . . . . 0.0 110.916 178.411 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.478 HD22 ' HA ' ' A' ' 7' ' ' LYS . 91.7 mt -70.36 -34.49 72.67 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 115.37 -0.832 . . . . 0.0 111.656 -177.084 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . . . . . . . . . 65.6 mt -66.0 -51.01 65.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.852 0 N-CA-C 109.622 -0.51 . . . . 0.0 109.622 178.102 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.4 tt0 -59.88 -51.41 69.81 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.932 0.893 . . . . 0.0 111.025 -179.312 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -64.43 -34.93 79.32 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.565 0.746 . . . . 0.0 112.23 -175.391 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 90.8 t80 -71.77 -54.44 10.22 Favored 'General case' 0 CA--C 1.547 0.847 0 C-N-CA 122.722 0.409 . . . . 0.0 110.489 179.011 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 84.0 mt -68.94 -37.68 79.01 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.516 0.726 . . . . 0.0 112.208 -171.112 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 77.1 m-20 -81.55 -16.77 50.67 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 122.682 0.393 . . . . 0.0 111.564 -177.238 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.9 t -76.26 -15.71 59.95 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 122.528 0.331 . . . . 0.0 110.824 175.723 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 76.0 mt-30 -74.72 -52.63 11.04 Favored 'General case' 0 C--N 1.35 0.6 0 C-N-CA 123.595 0.758 . . . . 0.0 110.166 178.051 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 54.7 pttt . . . . . 0 CA--C 1.561 1.39 0 CA-C-N 115.896 -0.593 . . . . 0.0 110.708 179.449 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.987 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 11.8 ptp180 -116.56 -12.2 10.99 Favored 'General case' 0 N--CA 1.482 1.13 0 C-N-CA 124.367 1.067 . . . . 0.0 110.764 173.843 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 15.0 p -56.7 123.6 15.51 Favored 'General case' 0 C--N 1.355 0.825 0 C-N-CA 123.615 0.766 . . . . 0.0 110.718 176.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.0 mptt -62.58 111.82 2.22 Favored 'General case' 0 N--CA 1.474 0.751 0 N-CA-C 108.694 -0.854 . . . . 0.0 108.694 177.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 16.7 mt-30 -80.9 74.71 7.87 Favored 'General case' 0 CA--C 1.53 0.179 0 CA-C-O 121.782 0.801 . . . . 0.0 109.187 -179.233 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 25.6 m -104.44 153.47 21.07 Favored 'General case' 0 C--O 1.243 0.749 0 CA-C-N 113.885 -1.507 . . . . 0.0 108.971 -176.649 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -155.09 140.24 17.5 Favored 'General case' 0 C--O 1.239 0.546 0 N-CA-C 109.359 -0.608 . . . . 0.0 109.359 171.383 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.422 ' O ' ' HB3' ' A' ' 39' ' ' ASN . 15.1 ttt85 -82.27 137.64 34.79 Favored 'General case' 0 C--N 1.325 -0.474 0 CA-C-N 114.609 -1.178 . . . . 0.0 109.637 178.854 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.242 0.683 0 O-C-N 122.083 -0.386 . . . . 0.0 110.299 170.232 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 67.3 m -70.82 -12.79 61.76 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.423 0.689 . . . . 0.0 111.276 176.781 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 4.4 t -145.92 94.55 2.5 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 122.078 0.942 . . . . 0.0 110.023 175.367 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -96.07 56.56 1.53 Allowed Glycine 0 C--N 1.342 0.908 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 168.369 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 97.62 -170.76 25.72 Favored Glycine 0 C--N 1.345 1.046 0 CA-C-N 114.69 -0.755 . . . . 0.0 111.302 -167.298 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 15.7 ptpt -141.97 155.55 45.46 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 123.449 0.7 . . . . 0.0 110.115 -178.225 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.253 1.262 0 C-N-CA 124.08 0.952 . . . . 0.0 109.995 -176.092 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.65 0 N-CA-C 112.718 -0.153 . . . . 0.0 112.718 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 32.8 tt0 -89.73 122.97 33.33 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 109.219 -0.659 . . . . 0.0 109.219 173.924 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 83.5 t80 -135.26 156.83 48.32 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 124.099 0.96 . . . . 0.0 109.322 177.024 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . 0.422 ' HA ' ' HA ' ' B' ' 6' ' ' THR . 3.7 p -69.61 109.84 2.6 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.96 0.886 . . . . 0.0 111.193 176.226 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.473 HG21 HD22 ' A' ' 22' ' ' LEU . 1.7 p -76.85 140.5 17.05 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.603 0 CA-C-N 115.605 -0.725 . . . . 0.0 109.223 171.082 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . 0.522 ' HB2' ' HA ' ' A' ' 25' ' ' LYS . 35.1 tt0 -68.31 -59.51 3.14 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.408 0.683 . . . . 0.0 110.162 176.356 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 21.3 ptmt -166.41 164.87 17.36 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 115.857 -0.61 . . . . 0.0 111.598 -176.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.458 HG23 ' HB3' ' A' ' 45' ' ' LEU . 91.6 t -83.72 137.3 21.16 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.598 0 C-N-CA 124.089 0.955 . . . . 0.0 108.969 170.561 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 78.5 mt -110.01 -29.58 8.17 Favored 'General case' 0 N--CA 1.476 0.838 0 C-N-CA 123.354 0.661 . . . . 0.0 110.805 178.292 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 6.8 t70 -160.31 165.33 31.5 Favored 'General case' 0 CA--C 1.545 0.778 0 C-N-CA 122.691 0.396 . . . . 0.0 110.65 -173.306 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 47.2 ttt180 -139.01 134.86 33.61 Favored 'General case' 0 CA--C 1.549 0.942 0 C-N-CA 125.109 1.364 . . . . 0.0 109.754 -179.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 38.9 ptt180 -134.04 175.69 9.25 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 124.534 1.134 . . . . 0.0 109.493 175.581 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 99.0 t -125.23 114.67 41.07 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.718 0 C-N-CA 123.594 0.758 . . . . 0.0 109.654 173.43 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 73.3 t -126.85 131.76 70.71 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.998 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 173.558 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 20.9 t-20 70.63 14.52 7.2 Favored 'General case' 0 N--CA 1.485 1.307 0 O-C-N 124.714 1.259 . . . . 0.0 110.924 -177.315 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 80.0 9.29 86.84 Favored Glycine 0 C--N 1.351 1.381 0 CA-C-N 116.184 -0.462 . . . . 0.0 113.074 -173.688 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -112.25 155.54 23.86 Favored 'General case' 0 N--CA 1.476 0.837 0 C-N-CA 124.615 1.166 . . . . 0.0 108.986 -179.807 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 56.2 t -96.4 119.98 45.17 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.814 0 C-N-CA 123.72 0.808 . . . . 0.0 109.632 -171.284 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.644 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 50.6 mt-10 -119.56 138.5 53.16 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 123.417 0.687 . . . . 0.0 110.017 -178.271 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . . . . . . . . . 97.9 m-85 -113.93 132.33 55.98 Favored 'General case' 0 N--CA 1.469 0.497 0 C-N-CA 124.1 0.96 . . . . 0.0 110.25 -176.464 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 33.4 t80 -78.12 107.82 10.97 Favored 'General case' 0 N--CA 1.469 0.517 0 N-CA-C 108.135 -1.061 . . . . 0.0 108.135 177.317 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.473 HD22 HG21 ' A' ' 5' ' ' VAL . 39.9 mt -97.74 122.41 40.8 Favored 'General case' 0 C--O 1.237 0.438 0 CA-C-N 115.943 -0.571 . . . . 0.0 111.352 -171.249 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 6.5 tmtt? -79.89 113.69 18.24 Favored 'General case' 0 C--O 1.216 -0.663 0 N-CA-C 105.33 -2.1 . . . . 0.0 105.33 161.169 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.552 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 88.7 m95 -82.75 139.02 33.84 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.119 0.568 . . . . 0.0 110.005 178.59 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . 0.522 ' HA ' ' HB2' ' A' ' 6' ' ' GLU . 59.2 tttp -62.67 -59.2 5.23 Favored 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.563 0.745 . . . . 0.0 112.009 -166.76 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -89.29 29.07 6.28 Favored Glycine 0 CA--C 1.534 1.278 0 CA-C-N 116.13 -0.486 . . . . 0.0 113.649 178.15 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.552 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 88.7 m-85 -135.69 167.37 21.27 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.407 1.083 . . . . 0.0 109.836 174.925 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 74.4 p -82.8 171.81 13.54 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.509 0.724 . . . . 0.0 111.869 -175.507 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 26.0 m-20 -70.26 -30.23 67.22 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.604 0.762 . . . . 0.0 110.98 176.782 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.96 -22.85 60.64 Favored 'General case' 0 CA--C 1.551 0.988 0 C-N-CA 123.546 0.738 . . . . 0.0 111.101 177.683 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . 0.411 ' OD2' HM21 ' B' ' 9' ' ' M3L . 10.9 t70 -94.59 10.89 33.02 Favored 'General case' 0 CA--C 1.558 1.261 0 C-N-CA 123.43 0.692 . . . . 0.0 111.396 -177.539 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . . . . . . . . . 1.0 OUTLIER -66.8 142.83 57.22 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.095 0.958 . . . . 0.0 111.662 174.848 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 27.9 p -141.33 155.61 45.93 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.609 0.764 . . . . 0.0 110.976 -176.031 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.2 m95 -87.29 111.26 20.87 Favored 'General case' 0 N--CA 1.476 0.87 0 C-N-CA 123.787 0.835 . . . . 0.0 110.912 179.224 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . . . . . . . . . 43.4 mm-40 -117.73 126.96 26.95 Favored Pre-proline 0 N--CA 1.472 0.659 0 N-CA-C 109.49 -0.559 . . . . 0.0 109.49 177.791 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.644 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.9 Cg_endo -67.01 157.22 62.8 Favored 'Trans proline' 0 C--N 1.367 1.531 0 C-N-CA 122.497 2.131 . . . . 0.0 112.886 178.717 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -55.82 -30.63 61.71 Favored 'General case' 0 N--CA 1.482 1.174 0 C-N-CA 124.575 1.15 . . . . 0.0 112.885 178.828 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . . . . . . . . . 8.4 pt-20 -67.43 -33.89 76.09 Favored 'General case' 0 CA--C 1.545 0.769 0 CA-C-O 121.642 0.734 . . . . 0.0 110.346 177.449 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.404 ' OD1' ' HB3' ' B' ' 8' ' ' ARG . 60.1 t30 -89.5 -18.92 25.75 Favored 'General case' 0 CA--C 1.549 0.908 0 C-N-CA 124.854 1.262 . . . . 0.0 110.833 -175.229 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.566 HD12 HD11 ' A' ' 46' ' ' ILE . 23.3 mt -70.51 162.73 28.26 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 122.784 0.434 . . . . 0.0 110.655 176.19 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 32.5 t70 -137.07 34.21 2.59 Favored 'General case' 0 CA--C 1.543 0.691 0 N-CA-C 107.981 -1.118 . . . . 0.0 107.981 175.995 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 24.4 p -147.76 95.01 4.29 Favored Pre-proline 0 C--N 1.355 0.818 0 CA-C-N 114.894 -1.048 . . . . 0.0 110.497 -178.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 96.2 Cg_endo -75.86 -16.11 18.54 Favored 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.234 1.956 . . . . 0.0 111.323 169.876 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 40.4 tt0 -60.5 -43.8 96.65 Favored 'General case' 0 CA--C 1.545 0.753 0 C-N-CA 124.457 1.103 . . . . 0.0 111.218 178.678 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . 0.468 HD21 ' HG3' ' B' ' 5' ' ' GLN . 69.6 mt -72.95 -44.59 60.97 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.865 0.466 . . . . 0.0 111.787 178.407 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.566 HD11 HD12 ' A' ' 40' ' ' LEU . 63.4 mt -60.94 -45.16 98.9 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 123.819 0.699 . . . . 0.0 110.536 -176.783 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 43.1 tt0 -63.51 -52.99 58.85 Favored 'General case' 0 C--O 1.22 -0.499 0 CA-C-N 115.205 -0.907 . . . . 0.0 110.339 176.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -57.32 -32.5 66.77 Favored 'General case' 0 N--CA 1.491 1.578 0 C-N-CA 123.696 0.798 . . . . 0.0 112.216 -179.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 54.1 t80 -67.29 -42.95 82.91 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 124.647 1.179 . . . . 0.0 110.684 177.523 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . . . . . . . . . 90.2 mt -75.84 -32.34 59.74 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.162 0.585 . . . . 0.0 110.702 179.082 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.42 -26.68 60.22 Favored 'General case' 0 N--CA 1.489 1.52 0 C-N-CA 124.277 1.031 . . . . 0.0 110.271 -179.192 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 35.9 t -65.08 -33.21 75.49 Favored 'General case' 0 CA--C 1.545 0.757 0 C-N-CA 123.842 0.857 . . . . 0.0 110.293 173.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 65.3 mt-30 -75.66 -29.22 59.02 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.985 0.914 . . . . 0.0 111.245 -177.896 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 4.1 ttmp? . . . . . 0 C--O 1.251 1.178 0 N-CA-C 109.228 -0.656 . . . . 0.0 109.228 174.444 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.21 0 N-CA-C 110.075 -0.343 . . . . 0.0 110.075 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 41.3 mmt180 64.62 15.45 9.7 Favored 'General case' 0 N--CA 1.494 1.774 0 C-N-CA 125.156 1.382 . . . . 0.0 112.868 178.621 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 17.0 m 55.88 75.95 0.31 Allowed 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.617 1.167 . . . . 0.0 110.722 -175.642 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 33.2 mmtp -109.16 89.76 3.09 Favored 'General case' 0 N--CA 1.474 0.749 0 N-CA-C 108.508 -0.923 . . . . 0.0 108.508 176.345 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.468 ' HG3' HD21 ' A' ' 45' ' ' LEU . 16.5 pm0 -110.54 104.43 13.15 Favored 'General case' 0 CA--C 1.551 1.001 0 CA-C-O 121.901 0.858 . . . . 0.0 109.373 -172.911 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . 0.422 ' HA ' ' HA ' ' A' ' 4' ' ' VAL . 14.8 p -113.29 169.39 8.98 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 124.173 0.989 . . . . 0.0 111.133 -175.988 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -164.47 159.28 19.25 Favored 'General case' 0 CA--C 1.515 -0.372 0 C-N-CA 123.79 0.836 . . . . 0.0 109.176 178.727 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . 0.404 ' HB3' ' OD1' ' A' ' 39' ' ' ASN . 32.8 ttm-85 -111.33 163.14 14.29 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.778 -0.823 . . . . 0.0 108.778 -175.95 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.411 HM21 ' OD2' ' A' ' 31' ' ' ASP . . . . . . . . 0 N--CA 1.49 1.548 0 N-CA-C 113.026 0.75 . . . . 0.0 113.026 179.166 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 39.6 p -173.82 118.62 0.27 Allowed 'General case' 0 N--CA 1.476 0.825 0 C-N-CA 123.875 0.87 . . . . 0.0 109.172 175.778 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 35.8 m -55.42 -48.98 73.57 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.028 0.931 . . . . 0.0 110.452 177.917 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . -82.78 77.21 2.14 Favored Glycine 0 CA--C 1.53 0.969 0 N-CA-C 109.861 -1.296 . . . . 0.0 109.861 167.424 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . -74.92 77.24 1.14 Allowed Glycine 0 C--N 1.355 1.619 0 C-N-CA 123.891 0.757 . . . . 0.0 112.463 -176.092 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 19.0 ptpt -153.17 151.59 30.3 Favored 'General case' 0 N--CA 1.477 0.881 0 C-N-CA 124.384 1.074 . . . . 0.0 109.717 -177.999 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.252 1.215 0 N-CA-C 109.154 -0.684 . . . . 0.0 109.154 178.917 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.647 0 N-CA-C 111.961 -0.456 . . . . 0.0 111.961 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 10.8 pt-20 -73.94 -49.01 26.61 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-N 116.717 0.259 . . . . 0.0 111.64 -175.581 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 73.0 m-85 -119.49 115.32 23.81 Favored 'General case' 0 N--CA 1.47 0.566 0 CA-C-O 121.412 0.625 . . . . 0.0 109.377 175.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 4.2 p -83.81 135.91 23.85 Favored 'Isoleucine or valine' 0 C--O 1.235 0.3 0 CA-C-N 115.033 -0.985 . . . . 0.0 109.607 177.248 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . 0.507 HG21 ' HG ' ' A' ' 22' ' ' LEU . 1.5 p -112.99 130.7 66.37 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.507 0 N-CA-C 109.232 -0.655 . . . . 0.0 109.232 176.0 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 30.5 tt0 -64.77 -63.87 1.01 Allowed 'General case' 0 CA--C 1.54 0.567 0 C-N-CA 124.252 1.021 . . . . 0.0 110.171 173.4 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 25.6 pttm -165.05 169.68 16.0 Favored 'General case' 0 N--CA 1.473 0.701 0 CA-C-N 115.779 -0.646 . . . . 0.0 109.767 -178.01 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.593 HG11 ' HD2' ' A' ' 20' ' ' TYR . 99.8 t -83.08 144.64 9.73 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.71 0 CA-C-N 115.732 -0.667 . . . . 0.0 109.815 171.631 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 96.7 mt -109.44 -31.63 7.45 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.754 0.822 . . . . 0.0 111.289 -179.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.4 t70 -154.23 161.84 41.56 Favored 'General case' 0 N--CA 1.479 1.007 0 N-CA-C 109.924 -0.399 . . . . 0.0 109.924 -176.047 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . 0.411 HH21 HG11 ' A' ' 18' ' ' VAL . 47.9 ttt180 -133.76 141.37 47.47 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.471 0.708 . . . . 0.0 109.223 -179.893 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 7.0 ptm180 -148.25 171.43 15.97 Favored 'General case' 0 N--CA 1.473 0.692 0 C-N-CA 122.955 0.502 . . . . 0.0 110.4 178.33 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 61.8 t -119.79 120.82 64.46 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 C-N-CA 123.76 0.824 . . . . 0.0 109.216 175.042 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 63.1 t -131.62 126.49 57.84 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.013 0 C-N-CA 124.21 1.004 . . . . 0.0 108.703 177.219 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 12.5 m120 67.23 18.06 10.31 Favored 'General case' 0 N--CA 1.493 1.68 0 C-N-CA 124.938 1.295 . . . . 0.0 111.267 179.833 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 89.56 -18.05 48.66 Favored Glycine 0 CA--C 1.528 0.883 0 CA-C-N 115.977 -0.556 . . . . 0.0 112.561 -172.881 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . . . . . . . . . 1.9 ptpp? -78.26 162.71 26.34 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 123.622 0.769 . . . . 0.0 110.128 -177.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . 0.411 HG11 HH21 ' A' ' 11' ' ' ARG . 82.4 t -107.81 106.93 21.6 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 123.527 0.731 . . . . 0.0 109.391 -175.413 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.562 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 89.8 mt-10 -105.14 152.86 22.29 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 123.327 0.651 . . . . 0.0 111.225 -178.467 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.593 ' HD2' HG11 ' A' ' 8' ' ' VAL . 92.3 m-85 -132.53 136.5 46.67 Favored 'General case' 0 CA--C 1.532 0.273 0 C-N-CA 125.074 1.35 . . . . 0.0 107.777 179.804 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 38.5 t80 -79.59 105.77 11.14 Favored 'General case' 0 N--CA 1.465 0.298 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 174.434 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.548 HD21 HD22 ' A' ' 40' ' ' LEU . 10.2 mp -86.88 113.53 22.75 Favored 'General case' 0 C--O 1.236 0.389 0 C-N-CA 123.398 0.679 . . . . 0.0 110.777 -178.475 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . . . . . . . . . 5.7 tmtm? -72.84 97.65 2.29 Favored 'General case' 0 N--CA 1.448 -0.528 0 N-CA-C 106.586 -1.635 . . . . 0.0 106.586 168.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.575 ' HD1' ' HA ' ' A' ' 32' ' ' ASN . 83.6 m95 -65.1 123.43 19.47 Favored 'General case' 0 C--O 1.239 0.505 0 N-CA-C 108.848 -0.797 . . . . 0.0 108.848 174.808 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 85.0 tttt -64.95 115.49 5.43 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.398 1.061 . . . . 0.0 110.612 -172.905 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . 95.08 -4.05 67.39 Favored Glycine 0 C--N 1.345 1.039 0 CA-C-N 115.667 -0.697 . . . . 0.0 113.475 -179.734 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.424 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 96.4 m-85 -109.7 142.25 41.15 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.964 0.905 . . . . 0.0 110.073 -179.927 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 8.6 t -62.37 152.45 34.0 Favored 'General case' 0 CA--C 1.548 0.901 0 C-N-CA 123.775 0.83 . . . . 0.0 111.643 -178.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 5.8 m-20 -68.84 -23.28 64.23 Favored 'General case' 0 N--CA 1.484 1.227 0 C-N-CA 123.903 0.881 . . . . 0.0 112.747 -172.341 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -72.82 -31.16 64.6 Favored 'General case' 0 CA--C 1.549 0.929 0 C-N-CA 122.902 0.481 . . . . 0.0 110.634 173.097 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 27.8 t70 -80.08 -30.2 39.24 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.706 0.802 . . . . 0.0 111.196 177.335 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.575 ' HA ' ' HD1' ' A' ' 24' ' ' TRP . 11.2 m120 -61.46 143.36 56.02 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 123.215 0.606 . . . . 0.0 111.195 179.859 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 64.9 p -126.97 169.28 13.48 Favored 'General case' 0 N--CA 1.491 1.6 0 C-N-CA 123.206 0.602 . . . . 0.0 112.268 -164.093 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.9 m95 -88.25 114.66 25.09 Favored 'General case' 0 N--CA 1.476 0.852 0 C-N-CA 123.743 0.817 . . . . 0.0 109.854 173.782 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.471 ' HB2' HD13 ' A' ' 22' ' ' LEU . 72.8 mm-40 -117.98 131.45 24.15 Favored Pre-proline 0 C--O 1.239 0.542 0 C-N-CA 123.441 0.696 . . . . 0.0 109.766 173.759 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.562 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 67.8 Cg_endo -72.09 153.93 57.38 Favored 'Trans proline' 0 C--N 1.364 1.383 0 C-N-CA 122.188 1.925 . . . . 0.0 112.18 174.489 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -56.54 -30.68 63.37 Favored 'General case' 0 N--CA 1.493 1.69 0 C-N-CA 124.192 0.997 . . . . 0.0 112.178 179.286 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.527 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 16.2 pt-20 -70.8 -8.81 55.17 Favored 'General case' 0 CA--C 1.554 1.109 0 C-N-CA 124.397 1.079 . . . . 0.0 111.477 -178.687 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . . . . . . . . . 65.8 t30 -115.6 -7.28 12.19 Favored 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.159 0.983 . . . . 0.0 110.72 -174.942 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.548 HD22 HD21 ' A' ' 22' ' ' LEU . 14.1 mt -86.73 143.09 27.71 Favored 'General case' 0 N--CA 1.486 1.344 0 C-N-CA 123.036 0.534 . . . . 0.0 112.04 -175.837 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 35.2 m-20 -93.12 -6.45 47.97 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.048 0.539 . . . . 0.0 110.305 172.013 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . 0.548 ' HB3' ' HA ' ' B' ' 5' ' ' GLN . 21.2 p -107.15 98.47 22.4 Favored Pre-proline 0 CA--C 1.552 1.02 0 C-N-CA 124.06 0.944 . . . . 0.0 111.162 -175.908 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 72.1 Cg_endo -75.9 -27.35 8.69 Favored 'Trans proline' 0 C--N 1.378 2.083 0 C-N-CA 122.339 2.026 . . . . 0.0 111.666 173.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 27.8 tt0 -61.21 -47.12 87.6 Favored 'General case' 0 C--N 1.355 0.807 0 C-N-CA 123.766 0.827 . . . . 0.0 111.154 -177.786 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 83.9 mt -71.13 -29.65 65.51 Favored 'General case' 0 N--CA 1.483 1.184 0 C-N-CA 123.26 0.624 . . . . 0.0 111.762 -175.5 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.402 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 72.6 mt -66.19 -54.12 29.96 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.81 0 N-CA-C 109.51 -0.552 . . . . 0.0 109.51 175.566 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 4.9 tm-20 -54.56 -53.51 53.52 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.326 1.05 . . . . 0.0 109.671 176.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -66.18 -33.09 74.97 Favored 'General case' 0 N--CA 1.466 0.368 0 CA-C-N 114.801 -1.091 . . . . 0.0 111.792 -168.106 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . . . . . . . . . 84.2 t80 -65.86 -50.38 64.78 Favored 'General case' 0 N--CA 1.474 0.753 0 O-C-N 123.437 0.461 . . . . 0.0 110.246 175.038 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.499 ' HA ' HE21 ' A' ' 53' ' ' GLN . 72.6 mt -62.92 -32.13 73.35 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 123.841 0.713 . . . . 0.0 110.247 -179.608 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 45.9 t-20 -71.31 -39.33 71.51 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.825 1.25 . . . . 0.0 109.463 177.449 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 22.8 t -70.65 -27.73 64.27 Favored 'General case' 0 N--CA 1.471 0.614 0 CA-C-N 115.57 -0.741 . . . . 0.0 111.299 -177.743 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.499 HE21 ' HA ' ' A' ' 50' ' ' LEU . 35.6 mt-30 -61.35 -29.3 69.81 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 122.712 0.405 . . . . 0.0 110.182 175.291 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . 0.469 ' NZ ' ' HA ' ' A' ' 54' ' ' LYS . 0.0 OUTLIER . . . . . 0 C--O 1.251 1.144 0 C-N-CA 123.173 0.589 . . . . 0.0 109.737 174.376 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.484 1.265 0 N-CA-C 110.193 -0.299 . . . . 0.0 110.193 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . . . . . . . . . 1.2 mpp_? -112.59 -65.71 1.15 Allowed 'General case' 0 N--CA 1.483 1.205 0 N-CA-C 109.126 -0.694 . . . . 0.0 109.126 179.456 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 27.2 p -104.34 157.34 17.21 Favored 'General case' 0 CA--C 1.547 0.837 0 C-N-CA 124.35 1.06 . . . . 0.0 109.848 178.12 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -88.66 102.85 15.38 Favored 'General case' 0 CA--C 1.549 0.915 0 C-N-CA 123.744 0.818 . . . . 0.0 110.631 -177.921 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . 0.548 ' HA ' ' HB3' ' A' ' 42' ' ' CYS . 2.2 mp0 -77.5 80.46 3.99 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.822 0.849 . . . . 0.0 110.985 177.685 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 35.4 p -142.67 176.31 9.14 Favored 'General case' 0 C--O 1.243 0.714 0 C-N-CA 124.041 0.937 . . . . 0.0 109.338 178.885 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -166.26 174.4 9.2 Favored 'General case' 0 C--O 1.261 1.686 0 CA-C-N 115.224 -0.898 . . . . 0.0 110.112 174.033 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 34.5 ttt180 -128.26 131.89 48.74 Favored 'General case' 0 C--O 1.237 0.399 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 -178.07 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . . . . . . . . . . . . . . . . 0 C--O 1.24 0.582 0 N-CA-C 110.024 -0.362 . . . . 0.0 110.024 -176.72 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 25.6 t -68.11 94.33 0.49 Allowed 'General case' 0 C--O 1.241 0.621 0 O-C-N 124.052 0.845 . . . . 0.0 109.533 -179.0 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 13.2 t -70.71 -17.75 62.82 Favored 'General case' 0 CA--C 1.549 0.918 0 CA-C-N 114.967 -1.015 . . . . 0.0 111.597 -177.578 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 113.77 160.44 13.75 Favored Glycine 0 C--N 1.348 1.231 0 N-CA-C 111.468 -0.653 . . . . 0.0 111.468 -176.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 78.7 25.51 60.43 Favored Glycine 0 CA--C 1.529 0.966 0 N-CA-C 112.385 -0.286 . . . . 0.0 112.385 -177.315 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 16.8 ttpp -87.12 89.79 8.12 Favored 'General case' 0 CA--C 1.546 0.82 0 N-CA-C 108.992 -0.744 . . . . 0.0 108.992 178.861 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.556 1.189 0 C-N-CA 123.85 0.86 . . . . 0.0 109.152 177.096 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 1.54 0 N-CA-C 112.135 -0.386 . . . . 0.0 112.135 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLU . . . . . . . . . . . . . 13.2 mp0 -77.76 148.06 35.02 Favored 'General case' 0 N--CA 1.481 1.077 0 C-N-CA 123.525 0.73 . . . . 0.0 109.408 -178.376 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' PHE . . . . . . . . . . . . . 63.6 m-85 -89.0 116.2 27.12 Favored 'General case' 0 C--O 1.239 0.518 0 N-CA-C 108.642 -0.873 . . . . 0.0 108.642 -179.881 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' VAL . . . . . . . . . . . . . 13.7 p -74.64 125.47 34.11 Favored 'Isoleucine or valine' 0 C--O 1.242 0.678 0 N-CA-C 109.293 -0.632 . . . . 0.0 109.293 176.397 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' VAL . . . . . . . . . . . . . 1.3 p -107.19 134.92 47.46 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.489 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.642 -177.025 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' GLU . . . . . . . . . . . . . 8.2 tp10 -66.95 -58.15 5.52 Favored 'General case' 0 N--CA 1.47 0.543 0 C-N-CA 124.543 1.137 . . . . 0.0 110.547 177.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' LYS . . . . . . . . . . . . . 22.5 ptmt -164.17 167.24 20.34 Favored 'General case' 0 N--CA 1.472 0.664 0 CA-C-N 115.337 -0.847 . . . . 0.0 110.883 -170.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' VAL . . . . . 0.439 HG13 ' HB3' ' A' ' 20' ' ' TYR . 65.2 t -94.18 141.5 14.8 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.628 0 N-CA-C 108.452 -0.944 . . . . 0.0 108.452 169.008 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' LEU . . . . . . . . . . . . . 88.4 mt -109.44 -38.39 5.48 Favored 'General case' 0 C--O 1.242 0.678 0 C-N-CA 124.076 0.95 . . . . 0.0 111.075 -175.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' ASP . . . . . . . . . . . . . 10.3 t70 -157.85 164.39 37.0 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 122.921 0.489 . . . . 0.0 110.218 -172.597 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' ARG . . . . . . . . . . . . . 56.7 ttt180 -130.88 138.83 49.99 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 124.657 1.183 . . . . 0.0 110.045 -177.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ARG . . . . . . . . . . . . . 4.7 ptm180 -132.88 163.04 30.01 Favored 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.281 1.032 . . . . 0.0 109.102 174.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' VAL . . . . . . . . . . . . . 38.0 t -130.87 109.07 16.11 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.811 0 N-CA-C 108.531 -0.915 . . . . 0.0 108.531 171.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' VAL . . . . . . . . . . . . . 3.2 m -118.78 125.2 74.24 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.603 0 C-N-CA 124.192 0.997 . . . . 0.0 110.6 178.193 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' ASN . . . . . . . . . . . . . 34.9 m-80 58.51 25.99 13.75 Favored 'General case' 0 N--CA 1.49 1.536 0 C-N-CA 124.658 1.183 . . . . 0.0 112.281 179.176 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 92.02 -16.87 58.53 Favored Glycine 0 CA--C 1.531 1.05 0 CA-C-N 115.969 -0.559 . . . . 0.0 113.286 -178.269 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' LYS . . . . . 0.406 ' HD2' ' HB3' ' A' ' 36' ' ' PRO . 6.3 ttpp -84.04 149.64 26.12 Favored 'General case' 0 CA--C 1.537 0.45 0 C-N-CA 124.048 0.939 . . . . 0.0 109.42 178.042 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' VAL . . . . . . . . . . . . . 77.8 t -115.98 114.44 46.18 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.924 0 C-N-CA 123.82 0.848 . . . . 0.0 109.307 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' GLU . . . . . 0.663 ' HA ' ' HA ' ' A' ' 36' ' ' PRO . 40.4 mt-10 -110.43 155.23 22.49 Favored 'General case' 0 N--CA 1.473 0.685 0 CA-C-O 121.154 0.502 . . . . 0.0 110.708 -179.284 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' TYR . . . . . 0.439 ' HB3' HG13 ' A' ' 8' ' ' VAL . 96.7 m-85 -128.36 130.23 47.42 Favored 'General case' 0 C--O 1.237 0.445 0 C-N-CA 124.246 1.018 . . . . 0.0 109.059 -177.924 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' PHE . . . . . . . . . . . . . 16.9 t80 -78.67 107.39 11.32 Favored 'General case' 0 N--CA 1.47 0.549 0 N-CA-C 108.345 -0.983 . . . . 0.0 108.345 -179.936 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' LEU . . . . . 0.477 HD11 HD22 ' A' ' 40' ' ' LEU . 39.1 mt -95.87 129.48 43.11 Favored 'General case' 0 C--N 1.328 -0.363 0 C-N-CA 122.843 0.457 . . . . 0.0 111.083 -171.898 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' LYS . . . . . 0.471 ' HG2' HD21 ' A' ' 32' ' ' ASN . 5.7 tmtm? -84.02 115.54 22.4 Favored 'General case' 0 N--CA 1.445 -0.708 0 N-CA-C 105.751 -1.944 . . . . 0.0 105.751 162.862 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' TRP . . . . . 0.553 ' HB2' ' HB2' ' A' ' 27' ' ' PHE . 82.1 m95 -79.71 130.37 35.29 Favored 'General case' 0 CA--C 1.536 0.424 0 C-N-CA 122.725 0.41 . . . . 0.0 109.959 179.21 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LYS . . . . . . . . . . . . . 20.5 ttpp -67.76 -46.13 72.95 Favored 'General case' 0 N--CA 1.474 0.732 0 C-N-CA 123.188 0.595 . . . . 0.0 111.792 -167.96 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLY . . . . . . . . . . . . . . . -96.17 20.36 50.48 Favored Glycine 0 CA--C 1.53 1.019 0 CA-C-N 115.716 -0.675 . . . . 0.0 113.409 -179.037 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.553 ' HB2' ' HB2' ' A' ' 24' ' ' TRP . 86.6 m-85 -140.0 171.27 14.43 Favored 'General case' 0 N--CA 1.489 1.487 0 C-N-CA 123.761 0.824 . . . . 0.0 111.152 -176.935 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' THR . . . . . . . . . . . . . 76.1 p -80.47 172.02 14.3 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.961 0.904 . . . . 0.0 112.777 -174.691 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ASP . . . . . . . . . . . . . 7.4 p-10 -71.67 -27.67 63.21 Favored 'General case' 0 N--CA 1.482 1.163 0 C-N-CA 124.434 1.094 . . . . 0.0 111.445 176.355 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' ALA . . . . . . . . . . . . . . . -71.05 -22.72 62.09 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.207 0.603 . . . . 0.0 110.953 175.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ASP . . . . . . . . . . . . . 23.4 t70 -85.34 -20.15 30.39 Favored 'General case' 0 CA--C 1.55 0.968 0 C-N-CA 124.283 1.033 . . . . 0.0 110.927 -179.369 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' ASN . . . . . 0.471 HD21 ' HG2' ' A' ' 23' ' ' LYS . 11.0 m-20 -48.87 121.69 4.95 Favored 'General case' 0 N--CA 1.491 1.622 0 C-N-CA 124.364 1.066 . . . . 0.0 111.643 176.155 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' THR . . . . . . . . . . . . . 15.3 p -136.46 158.13 45.16 Favored 'General case' 0 N--CA 1.475 0.794 0 C-N-CA 123.268 0.627 . . . . 0.0 112.003 -175.244 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' TRP . . . . . . . . . . . . . 96.7 m95 -81.4 113.09 19.25 Favored 'General case' 0 C--O 1.242 0.676 0 CA-C-N 115.197 -0.911 . . . . 0.0 110.568 176.93 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' GLU . . . . . 0.471 ' HB2' HD21 ' A' ' 40' ' ' LEU . 46.3 mm-40 -117.43 129.07 25.59 Favored Pre-proline 0 CA--C 1.544 0.714 0 N-CA-C 108.988 -0.745 . . . . 0.0 108.988 174.323 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' PRO . . . . . 0.663 ' HA ' ' HA ' ' A' ' 19' ' ' GLU . 39.6 Cg_endo -66.57 159.0 52.86 Favored 'Trans proline' 0 C--N 1.365 1.413 0 C-N-CA 122.526 2.151 . . . . 0.0 113.287 177.058 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' GLU . . . . . 0.425 ' HB3' ' HE2' ' A' ' 20' ' ' TYR . 0.2 OUTLIER -63.19 -28.31 69.96 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 123.654 0.781 . . . . 0.0 112.323 -177.532 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' GLU . . . . . 0.529 ' HG2' ' HB2' ' A' ' 36' ' ' PRO . 12.0 pt-20 -68.36 -20.68 64.72 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 124.156 0.982 . . . . 0.0 111.27 175.186 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' ASN . . . . . 0.57 HD21 ' HA ' ' B' ' 9' ' ' M3L . 67.2 t30 -103.91 -7.17 20.64 Favored 'General case' 0 CA--C 1.551 0.984 0 C-N-CA 124.618 1.167 . . . . 0.0 110.293 -175.056 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.477 HD22 HD11 ' A' ' 22' ' ' LEU . 18.5 mt -89.51 137.31 32.44 Favored 'General case' 0 N--CA 1.484 1.271 0 C-N-CA 123.206 0.602 . . . . 0.0 110.838 178.433 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' ASP . . . . . . . . . . . . . 34.5 t70 -100.07 -3.01 32.85 Favored 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.39 0.676 . . . . 0.0 109.438 170.495 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' CYS . . . . . . . . . . . . . 22.7 p -106.57 91.75 6.35 Favored Pre-proline 0 CA--C 1.552 1.032 0 C-N-CA 124.141 0.976 . . . . 0.0 110.618 179.853 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' PRO . . . . . . . . . . . . . 70.4 Cg_endo -86.31 -14.28 4.89 Favored 'Trans proline' 0 C--N 1.373 1.854 0 C-N-CA 122.423 2.082 . . . . 0.0 112.501 174.921 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' GLU . . . . . . . . . . . . . 33.2 tt0 -70.44 -44.11 68.5 Favored 'General case' 0 C--O 1.215 -0.744 0 C-N-CA 123.825 0.85 . . . . 0.0 109.843 176.916 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' LEU . . . . . . . . . . . . . 8.2 mp -65.21 -33.59 76.37 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 123.509 0.724 . . . . 0.0 111.01 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ILE . . . . . 0.53 ' O ' ' HG ' ' A' ' 50' ' ' LEU . 75.2 mt -64.41 -55.53 21.09 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.679 0 N-CA-C 109.265 -0.643 . . . . 0.0 109.265 174.173 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -56.26 -45.49 80.06 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.091 0.956 . . . . 0.0 111.326 -179.671 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' ALA . . . . . . . . . . . . . . . -62.11 -42.39 99.17 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 124.237 1.015 . . . . 0.0 110.802 -177.476 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' PHE . . . . . 0.427 ' O ' ' HG3' ' A' ' 53' ' ' GLN . 59.8 t80 -60.31 -50.48 73.46 Favored 'General case' 0 CA--C 1.546 0.79 0 CA-C-N 115.149 -0.932 . . . . 0.0 110.694 174.577 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' LEU . . . . . 0.53 ' HG ' ' O ' ' A' ' 46' ' ' ILE . 81.5 mt -62.06 -36.49 81.8 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 123.802 0.841 . . . . 0.0 111.255 -176.953 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' ASN . . . . . . . . . . . . . 0.9 OUTLIER -74.32 -40.09 62.44 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.915 0.886 . . . . 0.0 110.39 179.8 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' SER . . . . . . . . . . . . . 57.0 m -80.51 2.08 26.8 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.342 0.657 . . . . 0.0 112.563 -178.533 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.427 ' HG3' ' O ' ' A' ' 49' ' ' PHE . 77.2 mt-30 -69.56 -54.42 14.17 Favored 'General case' 0 CA--C 1.543 0.708 0 N-CA-C 109.135 -0.691 . . . . 0.0 109.135 170.52 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' LYS . . . . . . . . . . . . . 8.9 mptt . . . . . 0 C--O 1.249 1.058 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 178.132 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 1' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.841 0 N-CA-C 109.897 -0.409 . . . . 0.0 109.897 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' B' B ' 2' ' ' ARG . . . . . 0.403 HH11 ' HD2' ' B' ' 2' ' ' ARG . 0.0 OUTLIER -88.36 76.13 8.38 Favored 'General case' 0 N--CA 1.474 0.729 0 N-CA-C 107.687 -1.227 . . . . 0.0 107.687 174.588 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' B' B ' 3' ' ' THR . . . . . . . . . . . . . 22.7 m -96.49 100.12 11.73 Favored 'General case' 0 C--O 1.237 0.431 0 CA-C-N 115.353 -0.839 . . . . 0.0 109.965 -177.501 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 4' ' ' LYS . . . . . . . . . . . . . 13.1 mmmm -123.87 -21.61 5.09 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.618 0.767 . . . . 0.0 109.988 167.995 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 5' ' ' GLN . . . . . . . . . . . . . 70.8 mm-40 -79.74 77.83 6.35 Favored 'General case' 0 C--O 1.243 0.755 0 CA-C-O 121.934 0.873 . . . . 0.0 110.148 -177.928 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 6' ' ' THR . . . . . . . . . . . . . 36.3 p -126.28 177.56 6.35 Favored 'General case' 0 C--O 1.239 0.503 0 CA-C-N 114.321 -1.308 . . . . 0.0 109.861 -177.039 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 7' ' ' ALA . . . . . . . . . . . . . . . -149.93 171.83 16.17 Favored 'General case' 0 C--O 1.24 0.57 0 CA-C-N 115.272 -0.876 . . . . 0.0 109.134 178.665 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 8' ' ' ARG . . . . . . . . . . . . . 69.0 ttt180 -128.2 171.49 11.9 Favored 'General case' 0 C--N 1.319 -0.75 0 N-CA-C 107.419 -1.326 . . . . 0.0 107.419 -174.015 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 9' ' ' M3L . . . . . 0.57 ' HA ' HD21 ' A' ' 39' ' ' ASN . . . . . . . . 0 N--CA 1.488 1.429 0 C-N-CA 122.729 0.412 . . . . 0.0 111.994 176.719 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 10' ' ' SER . . . . . . . . . . . . . 29.3 t -167.86 100.19 0.47 Allowed 'General case' 0 CA--C 1.533 0.291 0 N-CA-C 108.712 -0.848 . . . . 0.0 108.712 175.296 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 11' ' ' THR . . . . . . . . . . . . . 28.3 m -50.43 -38.32 42.64 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.802 1.241 . . . . 0.0 111.546 177.951 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 12' ' ' GLY . . . . . . . . . . . . . . . 170.41 -57.47 0.19 Allowed Glycine 0 C--N 1.339 0.742 0 N-CA-C 110.359 -1.096 . . . . 0.0 110.359 178.726 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 13' ' ' GLY . . . . . . . . . . . . . . . 145.28 67.07 0.02 OUTLIER Glycine 0 C--N 1.343 0.943 0 N-CA-C 111.422 -0.671 . . . . 0.0 111.422 -179.751 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 14' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -70.66 93.61 0.94 Allowed 'General case' 0 CA--C 1.547 0.846 0 N-CA-C 109.369 -0.604 . . . . 0.0 109.369 176.94 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' B' B ' 15' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--O 1.25 1.083 0 C-N-CA 124.358 1.063 . . . . 0.0 109.737 -177.039 . . . . . . . . 0 0 . 1 stop_ save_