data_2jya_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 2jya _Structure_validation_residue.Date_analyzed 2016-10-07 loop_ _Residue_analysis_software.Software_ID _Residue_analysis_software.Software_label _Residue_analysis_software.Method_ID _Residue_analysis_software.Method_label _Residue_analysis_software.Entry_ID _Residue_analysis_software.Structure_validation_oneline_list_ID 1 MolProbity . . ? 1 2 CYRANGE . . ? 1 stop_ loop_ _Residue_analysis.ID _Residue_analysis.PDB_model_num _Residue_analysis.Hydrogen_positions _Residue_analysis.MolProbity_flips _Residue_analysis.Cyrange_core_flag _Residue_analysis.Two_letter_chain_ID _Residue_analysis.PDB_strand_ID _Residue_analysis.PDB_residue_no _Residue_analysis.PDB_ins_code _Residue_analysis.PDB_residue_name _Residue_analysis.Assembly_ID _Residue_analysis.Entity_assembly_ID _Residue_analysis.Entity_ID _Residue_analysis.Comp_ID _Residue_analysis.Comp_index_ID _Residue_analysis.Clash_value _Residue_analysis.Clash_source_PDB_atom_name _Residue_analysis.Clash_destination_PDB_atom_name _Residue_analysis.Clash_destination_PDB_strand_ID _Residue_analysis.Clash_destination_PDB_residue_no _Residue_analysis.Clash_destination_PDB_ins_code _Residue_analysis.Clash_destination_PDB_residue_name _Residue_analysis.Cbeta_deviation_value _Residue_analysis.Rotamer_score _Residue_analysis.Rotamer_name _Residue_analysis.Ramachandran_phi _Residue_analysis.Ramachandran_psi _Residue_analysis.Ramachandran_score _Residue_analysis.Ramachandran_evaluation _Residue_analysis.Ramachandran_type _Residue_analysis.Bond_outlier_count _Residue_analysis.Worst_bond _Residue_analysis.Worst_bond_value _Residue_analysis.Worst_bond_sigma _Residue_analysis.Angle_outlier_count _Residue_analysis.Worst_angle _Residue_analysis.Worst_angle_value _Residue_analysis.Worst_angle_sigma _Residue_analysis.RNA_phosphate_perpendicular_outlier _Residue_analysis.RNA_suitness_score _Residue_analysis.RNA_suite_conformer _Residue_analysis.RNA_suite_triage _Residue_analysis.Max_b_factor _Residue_analysis.Tau_angle _Residue_analysis.Omega_dihedral _Residue_analysis.Disulfide_chi1 _Residue_analysis.Disulfide_chi2 _Residue_analysis.Disulfide_chi3 _Residue_analysis.Disulfide_ss_angle _Residue_analysis.Disulfide_ss _Residue_analysis.Disulfide_ss_angle_prime _Residue_analysis.Disulfide_chi2prime _Residue_analysis.Disulfide_chi1prime _Residue_analysis.Outlier_count_separate_geometry _Residue_analysis.Outlier_count _Residue_analysis.Entry_ID _Residue_analysis.Structure_validation_residue_list_ID . 001 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.6 p . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 120.396 0.141 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.5 ' HB2' HD13 ' A' ' 25' ' ' LEU . . . -102.6 127.53 49.65 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.844 0.858 . . . . 0.0 109.172 175.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.402 ' HB2' HD13 ' A' ' 75' ' ' ILE . 17.2 ptpt -108.72 124.23 50.23 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -177.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.464 HG13 HD11 ' A' ' 25' ' ' LEU . 4.0 mp -107.87 121.24 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.473 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.9 p90 -150.59 160.05 44.08 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.429 0.633 . . . . 0.0 112.132 -173.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.9 mtp180 -122.16 96.61 46.3 Favored Pre-proline 0 N--CA 1.478 0.97 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 168.256 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 CA--C 1.552 1.424 0 C-N-CA 122.623 2.215 . . . . 0.0 111.676 178.297 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 C--O 1.249 1.076 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -82.51 125.43 31.11 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 177.284 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.9 t -100.07 135.97 33.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 3' ' ' ALA . 51.2 tp -116.37 104.0 11.03 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -104.97 135.92 45.41 Favored 'General case' 0 C--O 1.214 -0.772 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 176.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.6 p90 . . . . . 0 C--O 1.239 0.537 0 CA-C-N 118.559 0.618 . . . . 0.0 111.876 -178.642 . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.6 m . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -142.9 149.28 38.26 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-O 122.025 0.917 . . . . 0.0 113.437 -173.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.408 HD11 HD23 ' A' ' 25' ' ' LEU . 50.5 mt -119.2 158.9 25.06 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.522 1.929 . . . . 0.0 107.588 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.1 p -122.31 129.05 51.78 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 118.43 0.559 . . . . 0.0 110.622 175.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -130.63 148.53 52.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.258 1.423 . . . . 0.0 108.936 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.09 -22.36 62.11 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.771 0.428 . . . . 0.0 111.579 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.3 p -132.47 157.21 45.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.217 0.607 . . . . 0.0 111.169 178.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -58.82 -43.85 90.71 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.276 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -59.05 -35.54 73.52 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.687 1.242 . . . . 0.0 111.494 -175.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -74.03 -30.02 62.21 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.076 0.551 . . . . 0.0 112.04 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.33 -37.83 31.79 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.366 0.603 . . . . 0.0 110.903 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -71.92 -37.71 70.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.368 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.39 70.61 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.645 0.778 . . . . 0.0 112.171 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -61.3 -60.3 3.94 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.99 -47.69 64.76 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.973 1.309 . . . . 0.0 112.046 -177.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -60.81 -46.47 90.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.369 1.068 . . . . 0.0 111.341 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.7 ttt85 -63.36 -31.81 73.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.588 1.155 . . . . 0.0 111.396 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.21 -14.81 35.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.177 0.591 . . . . 0.0 111.462 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.04 -3.4 76.93 Favored Glycine 0 C--N 1.35 1.348 0 C-N-CA 122.823 0.249 . . . . 0.0 112.789 -176.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 59.3 mt -69.29 106.46 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -55.1 143.88 25.65 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.397 170.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -135.8 146.84 47.97 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.61 0.641 . . . . 0.0 112.116 -170.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -114.36 125.36 53.78 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 171.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 90.9 t -90.45 126.73 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 110.16 175.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.473 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 mp -105.93 112.39 39.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 170.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 72.0 mt . . . . . 0 CA--C 1.547 0.863 0 C-N-CA 123.633 0.773 . . . . 0.0 111.665 179.756 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.8 p . . . . . 0 N--CA 1.474 0.76 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.442 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.49 134.59 44.35 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.87 0.468 . . . . 0.0 110.908 -167.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.56 122.82 48.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 176.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.501 ' HB ' HG12 ' A' ' 74' ' ' VAL . 5.1 mp -107.21 122.57 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -147.78 172.99 13.24 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -175.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.5 ttp180 -116.48 119.99 35.31 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 170.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 29.6 Cg_endo . . . . . 0 CA--C 1.55 1.319 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.496 ' O ' ' HD2' ' A' ' 8' ' ' PRO . 28.8 m . . . . . 0 N--CA 1.47 0.544 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.7 m95 -93.11 132.75 36.96 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.39 0.676 . . . . 0.0 109.319 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.465 HG23 HG22 ' A' ' 54' ' ' THR . 70.3 t -102.54 138.66 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 tt -112.99 108.26 17.1 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -119.94 131.15 55.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.442 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 35.0 p90 . . . . . 0 N--CA 1.472 0.64 0 C-N-CA 123.522 0.729 . . . . 0.0 111.058 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.5 136.03 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.676 0.75 . . . . 0.0 111.363 -175.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.5 mp -123.81 153.91 40.33 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.591 1.556 . . . . 0.0 107.448 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.465 HG22 HG23 ' A' ' 24' ' ' VAL . 17.1 p -120.54 125.18 47.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.381 0.991 . . . . 0.0 111.154 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -124.44 145.49 49.47 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.905 1.682 . . . . 0.0 107.448 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -69.99 -22.63 63.12 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -172.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 45.1 p -135.72 162.38 32.93 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 110.146 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -61.64 -40.93 96.66 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.57 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -59.49 -39.54 84.09 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.713 0.805 . . . . 0.0 111.585 -175.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -67.7 -33.21 74.45 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.936 0.495 . . . . 0.0 111.337 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.03 -39.68 25.43 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.148 0.499 . . . . 0.0 111.046 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.38 -39.0 63.0 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.305 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.29 -32.34 73.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.485 0.714 . . . . 0.0 111.76 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -66.69 -49.25 66.7 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.16 84.07 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.094 0.958 . . . . 0.0 111.187 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -62.64 -42.96 99.89 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.957 0.903 . . . . 0.0 111.324 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -55.48 -36.74 66.94 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.965 1.306 . . . . 0.0 110.825 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -87.09 -21.0 26.3 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.041 -0.982 . . . . 0.0 110.882 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.62 -10.68 66.74 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.265 -0.742 . . . . 0.0 112.536 -174.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 52.7 mt -52.63 114.3 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.818 0.847 . . . . 0.0 111.512 -173.224 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -58.14 130.4 46.44 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 113.861 -1.518 . . . . 0.0 108.739 170.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -142.16 146.64 35.53 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.045 0.45 . . . . 0.0 111.509 -169.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -114.86 133.81 55.66 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.683 1.193 . . . . 0.0 107.797 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.501 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.7 m -103.32 127.48 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-O 121.389 0.614 . . . . 0.0 109.426 174.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.26 132.25 68.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 C-N-CA 125.432 1.493 . . . . 0.0 107.282 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 34.4 mt . . . . . 0 C--O 1.24 0.564 0 O-C-N 122.997 0.186 . . . . 0.0 110.573 173.84 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 50.4 m . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 . . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.11 136.41 41.0 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.965 0.506 . . . . 0.0 109.716 -173.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -108.24 123.55 48.95 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.46 HG12 HD12 ' A' ' 25' ' ' LEU . 59.3 mt -104.29 121.04 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -146.59 176.63 9.68 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -136.41 94.62 13.55 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.075 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo . . . . . 0 C--N 1.368 1.587 0 C-N-CA 123.483 2.789 . . . . 0.0 111.559 -172.981 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 111.547 0.203 . . . . 0.0 111.547 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -84.88 129.54 34.79 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.9 t -102.74 138.49 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.396 0.617 . . . . 0.0 109.739 175.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.46 HD12 HG12 ' A' ' 5' ' ' ILE . 60.4 tp -116.06 105.49 12.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -114.41 131.11 56.7 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.4 p90 . . . . . 0 C--O 1.235 0.317 0 C-N-CA 124.236 1.014 . . . . 0.0 110.713 178.21 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.472 0.638 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -142.62 136.25 28.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.631 0.729 . . . . 0.0 111.377 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.4 mp -121.64 147.59 45.66 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 113.866 -1.516 . . . . 0.0 107.2 -178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.4 p -113.16 132.55 55.43 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.261 0.624 . . . . 0.0 110.186 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.475 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.7 m-85 -132.85 148.24 52.3 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.298 1.439 . . . . 0.0 108.509 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.15 -26.75 64.08 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 123.283 0.364 . . . . 0.0 111.915 -177.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 58.6 p -133.17 163.27 29.66 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.05 0.54 . . . . 0.0 110.096 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -62.13 -39.1 91.42 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 114.959 -1.018 . . . . 0.0 110.828 171.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -53.06 -43.16 66.47 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.473 1.109 . . . . 0.0 111.469 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.475 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 64.3 mt-30 -67.74 -36.25 80.21 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.064 0.945 . . . . 0.0 111.395 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.03 -39.7 55.1 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.973 0.509 . . . . 0.0 111.127 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -70.85 -37.48 73.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.562 177.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.37 -38.72 69.21 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.523 0.729 . . . . 0.0 111.925 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -63.39 -60.62 3.14 Favored 'General case' 0 C--N 1.351 0.64 0 C-N-CA 123.325 0.65 . . . . 0.0 110.005 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.41 -47.41 66.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.489 1.115 . . . . 0.0 112.293 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -61.9 -45.8 92.17 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.006 0.922 . . . . 0.0 111.452 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -59.72 -34.37 72.84 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.081 0.952 . . . . 0.0 110.936 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -86.87 -20.56 27.26 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.333 0.653 . . . . 0.0 111.407 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.18 2.05 74.73 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 116.643 -0.253 . . . . 0.0 112.786 -173.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.97 110.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 122.568 0.347 . . . . 0.0 110.179 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.417 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.6 pt-20 -58.58 136.93 57.71 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 124.95 1.407 . . . . 0.0 108.407 170.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -144.42 151.52 39.36 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.357 0.526 . . . . 0.0 110.997 -171.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.449 ' NH1' HG13 ' A' ' 75' ' ' ILE . 3.5 tmt_? -125.44 140.34 52.86 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.516 1.127 . . . . 0.0 108.26 171.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -105.57 136.84 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.352 0.661 . . . . 0.0 111.032 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.449 HG13 ' NH1' ' A' ' 73' ' ' ARG . 2.3 mp -111.26 150.47 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.4 mt . . . . . 0 CA--C 1.556 1.205 0 C-N-CA 122.841 0.457 . . . . 0.0 110.987 173.959 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.9 m . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.684 0.278 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -102.31 144.39 30.86 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -107.71 124.92 50.73 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.589 HG23 ' HG2' ' A' ' 58' ' ' GLN . 70.3 mt -103.28 123.71 56.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.315 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 172.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -148.46 176.22 10.49 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -141.68 97.52 6.59 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 174.099 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo . . . . . 0 C--N 1.36 1.136 0 C-N-CA 121.715 1.61 . . . . 0.0 111.714 -176.108 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.7 m . . . . . 0 N--CA 1.474 0.768 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -85.17 132.17 34.33 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.6 t -101.06 139.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.13 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.509 HD22 HG12 ' A' ' 5' ' ' ILE . 3.4 tm? -116.84 104.6 11.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -107.81 137.48 45.75 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.4 p90 . . . . . 0 N--CA 1.476 0.86 0 C-N-CA 123.174 0.59 . . . . 0.0 109.9 -178.887 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.4 t . . . . . 0 C--O 1.24 0.568 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -137.44 146.54 44.47 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.772 0.796 . . . . 0.0 111.628 -173.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp -119.61 157.27 28.77 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.978 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 48.5 p -121.73 131.6 54.17 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 110.193 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -128.17 147.49 50.56 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.503 1.521 . . . . 0.0 107.982 178.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.05 -24.21 64.15 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.656 0.382 . . . . 0.0 111.84 -176.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 79.8 p -132.99 160.5 36.96 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 123.927 0.891 . . . . 0.0 110.193 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.589 ' HG2' HG23 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -60.88 -40.41 92.91 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.078 0.951 . . . . 0.0 110.317 170.803 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -57.3 -39.7 76.32 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.75 1.22 . . . . 0.0 111.754 -174.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -70.93 -30.78 67.19 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 122.963 0.505 . . . . 0.0 112.013 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.2 -40.08 53.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.202 0.601 . . . . 0.0 111.14 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -37.59 67.2 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.951 177.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.78 77.24 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.244 0.618 . . . . 0.0 111.98 173.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -65.61 -59.33 4.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.532 0.733 . . . . 0.0 110.384 176.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.28 -49.52 69.42 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.544 1.138 . . . . 0.0 112.583 -177.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -64.18 -37.84 88.9 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.402 0.681 . . . . 0.0 111.73 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -62.17 -30.96 71.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.929 0.892 . . . . 0.0 110.692 175.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -85.92 -21.93 27.7 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.496 0.718 . . . . 0.0 110.629 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.6 -1.75 62.08 Favored Glycine 0 C--N 1.35 1.354 0 O-C-N 123.321 0.388 . . . . 0.0 112.722 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 26.8 mt -68.11 109.34 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-O 121.601 0.715 . . . . 0.0 110.144 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -58.08 141.34 50.38 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.772 169.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -141.12 149.86 42.11 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.146 0.43 . . . . 0.0 111.391 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -120.97 127.65 52.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.747 0.819 . . . . 0.0 109.494 172.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.41 HG21 HD11 ' A' ' 5' ' ' ILE . 35.1 t -102.51 134.83 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 123.761 0.825 . . . . 0.0 108.872 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.9 mt -130.71 121.04 49.42 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -178.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 75.1 mt . . . . . 0 CA--C 1.544 0.713 0 C-N-CA 123.744 0.817 . . . . 0.0 112.032 -175.217 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 120.651 0.263 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.42 137.46 37.89 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.479 0.711 . . . . 0.0 109.224 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -112.81 123.69 50.89 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 mp -105.93 123.31 60.41 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 N-CA-C 106.779 -1.564 . . . . 0.0 106.779 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -150.88 174.53 12.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.224 1.01 . . . . 0.0 108.354 -177.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -139.73 98.08 7.98 Favored Pre-proline 0 C--O 1.242 0.688 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo . . . . . 0 C--N 1.366 1.498 0 C-N-CA 122.707 2.271 . . . . 0.0 112.186 -175.823 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -85.96 132.57 34.05 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -176.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.1 t -102.12 138.44 26.36 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.497 HD21 HD21 ' A' ' 53' ' ' LEU . 9.1 tt -114.82 107.81 15.92 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 172.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -108.7 134.84 50.88 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 174.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.1 p90 . . . . . 0 N--CA 1.474 0.756 0 CA-C-N 118.546 0.612 . . . . 0.0 112.053 -176.439 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 120.687 0.28 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.5 ptpt -133.69 132.43 40.65 Favored 'General case' 0 C--N 1.352 0.681 0 CA-C-O 121.771 0.796 . . . . 0.0 110.826 174.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.497 HD21 HD21 ' A' ' 25' ' ' LEU . 2.0 mm? -115.83 148.41 39.95 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.8 p -114.86 130.93 56.98 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.67 -0.644 . . . . 0.0 109.677 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -130.84 146.48 52.29 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.469 1.507 . . . . 0.0 108.32 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -68.63 -27.16 65.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.797 0.439 . . . . 0.0 112.169 -175.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.4 p -134.3 159.28 41.48 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.629 0.771 . . . . 0.0 110.352 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -56.33 -46.29 79.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.65 1.18 . . . . 0.0 111.4 172.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -51.19 -45.42 61.81 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 124.909 1.381 . . . . 0.0 111.992 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -70.85 -29.14 65.18 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.609 0.764 . . . . 0.0 111.774 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.66 -44.42 28.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.033 0.533 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.49 -37.75 74.27 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.649 -177.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.35 -36.35 75.55 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.403 0.681 . . . . 0.0 112.302 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -62.66 -57.13 12.11 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.254 0.621 . . . . 0.0 109.905 177.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.58 -47.74 66.66 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.494 1.117 . . . . 0.0 111.777 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -60.06 -45.92 91.26 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.248 1.019 . . . . 0.0 112.004 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -60.54 -31.0 70.12 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.147 . . . . 0.0 111.172 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -87.84 -21.03 25.27 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.621 0.769 . . . . 0.0 111.059 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.52 -3.8 63.67 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-O 119.984 -0.342 . . . . 0.0 112.628 -174.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 48.1 mt -63.14 108.89 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 CA-C-O 121.048 0.452 . . . . 0.0 109.873 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -57.73 139.99 52.55 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.489 172.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.0 p90 -142.18 147.8 37.19 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.851 0.751 . . . . 0.0 112.102 -168.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -121.04 110.4 16.2 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 175.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.4 t -83.73 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.6 mt -121.65 129.17 75.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 125.931 1.692 . . . . 0.0 108.04 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 CA--C 1.541 0.633 0 O-C-N 123.321 0.388 . . . . 0.0 110.863 175.724 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 20.1 t . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.407 ' HB3' HD13 ' A' ' 25' ' ' LEU . . . -100.66 136.55 40.35 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.608 0.763 . . . . 0.0 109.712 178.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -108.84 120.1 41.49 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 107.197 -1.409 . . . . 0.0 107.197 175.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.438 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.2 mp -104.54 123.15 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 177.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -151.48 173.04 15.06 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -176.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 68.0 ttt180 -138.84 97.16 9.05 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.082 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 C--N 1.365 1.421 0 C-N-CA 122.285 1.99 . . . . 0.0 111.502 -175.119 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.412 HG21 HG23 ' A' ' 54' ' ' THR . 9.6 m . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.626 0.25 . . . . 0.0 110.938 . . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.6 m95 -88.88 132.75 34.54 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.068 0.947 . . . . 0.0 109.338 -172.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.7 t -101.44 138.84 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.51 ' HB2' ' HB2' ' A' ' 61' ' ' ALA . 53.8 tp -114.42 106.69 14.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 125.369 1.468 . . . . 0.0 107.17 176.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -115.46 132.38 56.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.5 p90 . . . . . 0 C--O 1.243 0.746 0 C-N-CA 123.357 0.663 . . . . 0.0 110.592 177.163 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -138.79 138.69 37.82 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.515 176.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp -119.18 151.71 37.86 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.412 HG23 HG21 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -122.88 128.45 50.36 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.644 0.657 . . . . 0.0 110.539 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -129.05 154.88 46.24 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.834 1.254 . . . . 0.0 108.999 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -67.8 -29.6 68.81 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.569 0.543 . . . . 0.0 111.874 -177.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 56.7 p -133.04 161.14 35.15 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 123.43 0.692 . . . . 0.0 111.079 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -54.63 -48.99 71.57 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.117 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -45.37 -46.16 12.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.08 1.752 . . . . 0.0 113.288 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -70.32 -33.82 71.96 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.11 0.564 . . . . 0.0 112.039 -178.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.51 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . . . -80.42 -38.06 30.93 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.305 0.574 . . . . 0.0 110.753 -174.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -72.1 -40.25 68.31 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.387 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.52 70.94 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.254 0.622 . . . . 0.0 112.118 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -63.81 -57.1 10.94 Favored 'General case' 0 C--N 1.352 0.695 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.89 -46.46 67.98 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.494 1.118 . . . . 0.0 112.223 177.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -60.12 -47.69 84.87 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.41 1.084 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -57.84 -36.28 72.08 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.779 1.232 . . . . 0.0 111.253 177.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -80.96 -25.38 37.41 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.594 0.758 . . . . 0.0 111.011 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.29 -5.55 63.0 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.032 0.349 . . . . 0.0 112.499 -171.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.72 110.62 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.343 0 C-N-CA 123.399 0.68 . . . . 0.0 110.79 -177.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 2' ' ' SER . 1.6 pm0 -54.19 138.91 37.24 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 113.645 -1.616 . . . . 0.0 109.343 169.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -148.21 151.2 35.1 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.0 0.818 . . . . 0.0 112.087 -170.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.488 HH11 HG13 ' A' ' 75' ' ' ILE . 1.2 tmt_? -121.56 125.71 47.41 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.091 0.956 . . . . 0.0 108.651 171.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.438 HG12 ' HB ' ' A' ' 5' ' ' ILE . 33.9 m -93.49 137.88 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.68 0.792 . . . . 0.0 110.315 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.488 HG13 HH11 ' A' ' 73' ' ' ARG . 4.1 mp -121.1 137.32 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.576 1.15 . . . . 0.0 108.325 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 CA--C 1.547 0.854 0 C-N-CA 123.855 0.862 . . . . 0.0 111.469 -178.839 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.478 ' HB3' HD13 ' A' ' 25' ' ' LEU . . . -99.96 129.02 45.99 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.607 0.763 . . . . 0.0 109.973 -177.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -114.6 119.87 38.25 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.988 0.915 . . . . 0.0 108.587 179.103 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.478 HG13 HD11 ' A' ' 25' ' ' LEU . 3.6 mp -106.81 122.69 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -176.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -150.14 161.89 41.51 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.4 0.619 . . . . 0.0 111.73 -172.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -119.51 103.54 46.49 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.482 168.942 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo . . . . . 0 CA--C 1.55 1.281 0 C-N-CA 122.265 1.977 . . . . 0.0 112.015 -179.878 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.7 p . . . . . 0 C--O 1.244 0.8 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -85.04 127.3 34.16 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -101.43 136.94 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.535 HD21 HD11 ' A' ' 53' ' ' LEU . 58.8 tp -118.26 104.12 10.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.986 1.315 . . . . 0.0 108.715 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.548 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 43.4 mt-10 -104.68 136.92 43.31 Favored 'General case' 0 C--O 1.212 -0.921 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 p90 . . . . . 0 N--CA 1.476 0.844 0 CA-C-N 118.499 0.591 . . . . 0.0 109.918 174.473 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.9 m . . . . . 0 N--CA 1.472 0.671 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.548 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -135.94 140.27 43.89 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.563 0.696 . . . . 0.0 112.034 -174.151 . . . . . . . . 3 3 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.535 HD11 HD21 ' A' ' 25' ' ' LEU . 50.6 mt -116.81 156.01 27.98 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.609 1.564 . . . . 0.0 107.403 177.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.7 p -119.9 133.57 55.53 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.655 -0.653 . . . . 0.0 110.623 174.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.414 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 96.0 m-85 -135.54 147.67 48.85 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.886 1.275 . . . . 0.0 109.277 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -67.6 -24.62 65.51 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 123.601 0.563 . . . . 0.0 111.755 -174.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 76.1 p -134.44 163.13 30.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.398 0.679 . . . . 0.0 110.2 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -61.63 -39.5 91.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.471 0.708 . . . . 0.0 110.392 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -52.14 -44.62 64.65 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.747 1.279 . . . . 0.0 112.559 -176.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.414 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 48.3 mt-30 -70.97 -30.39 66.65 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.543 0.737 . . . . 0.0 111.976 -177.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.87 -38.61 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.306 0.643 . . . . 0.0 111.301 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -76.09 -39.02 56.27 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.82 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -30.68 71.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 111.695 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -64.42 -53.42 48.62 Favored 'General case' 0 C--N 1.354 0.803 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 174.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.43 -43.93 75.81 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.214 1.005 . . . . 0.0 111.724 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -64.56 -44.57 90.33 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.35 1.06 . . . . 0.0 111.663 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -64.39 -28.78 69.92 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.757 0.823 . . . . 0.0 110.659 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -89.18 -16.84 30.4 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.451 0.7 . . . . 0.0 111.072 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.23 -7.49 81.44 Favored Glycine 0 C--N 1.35 1.335 0 C-N-CA 123.261 0.458 . . . . 0.0 112.89 -176.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.2 mt -59.35 112.01 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 123.233 0.613 . . . . 0.0 110.458 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -55.13 135.83 48.9 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.646 173.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -141.22 144.9 34.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.492 1.042 . . . . 0.0 112.505 -170.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 18.7 tpp180 -116.92 138.11 51.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.52 1.528 . . . . 0.0 108.298 170.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.45 HG11 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -105.06 133.34 49.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-O 121.113 0.482 . . . . 0.0 110.328 174.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.3 mp -104.12 112.26 36.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.1 mt . . . . . 0 CA--C 1.543 0.694 0 C-N-CA 123.747 0.819 . . . . 0.0 111.328 -175.793 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.2 138.61 38.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -167.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -107.23 122.04 45.74 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 175.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.503 HG13 HD21 ' A' ' 25' ' ' LEU . 4.3 mp -103.44 122.95 56.64 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -150.15 178.15 9.25 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.416 ' HD2' ' NE1' ' A' ' 23' ' ' TRP . 15.6 ttt180 -136.89 97.14 11.27 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo . . . . . 0 C--N 1.366 1.492 0 C-N-CA 122.913 2.409 . . . . 0.0 113.211 -165.554 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.443 HG23 ' HB ' ' A' ' 54' ' ' THR . 14.1 p . . . . . 0 CA--C 1.544 0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.416 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 67.8 m95 -88.72 131.86 34.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.5 t -101.14 139.88 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.503 HD21 HG13 ' A' ' 5' ' ' ILE . 3.2 tm? -114.64 104.35 11.9 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 105.828 -1.915 . . . . 0.0 105.828 174.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -113.35 131.73 55.85 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.2 p90 . . . . . 0 N--CA 1.476 0.843 0 C-N-CA 123.597 0.759 . . . . 0.0 110.715 178.266 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 14.7 ptpt -144.0 139.01 28.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.588 0.708 . . . . 0.0 111.796 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.5 mt -118.47 157.79 26.58 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.469 1.507 . . . . 0.0 108.026 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.443 ' HB ' HG23 ' A' ' 22' ' ' VAL . 34.7 p -119.01 135.09 54.8 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.177 0.591 . . . . 0.0 109.956 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.522 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.9 m-85 -138.38 148.45 44.52 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.206 1.402 . . . . 0.0 109.787 -178.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -63.14 -32.98 74.49 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.353 0.661 . . . . 0.0 111.896 -174.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.9 p -134.65 164.12 28.22 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.658 0.783 . . . . 0.0 111.274 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.2 -46.1 86.42 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.137 173.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -48.42 -43.81 34.58 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 124.999 1.437 . . . . 0.0 112.811 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.522 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 78.2 mt-30 -70.12 -35.15 73.9 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.529 0.731 . . . . 0.0 111.774 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . . . -76.84 -39.12 52.3 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.491 0.662 . . . . 0.0 110.653 -175.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -30.22 55.43 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.09 -36.0 76.42 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.296 0.639 . . . . 0.0 111.757 173.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -62.2 -58.44 7.76 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.58 -48.09 63.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.948 1.299 . . . . 0.0 112.423 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -61.06 -46.1 92.05 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.318 1.047 . . . . 0.0 111.392 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -59.56 -34.85 73.21 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.536 1.135 . . . . 0.0 111.242 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -87.66 -20.49 26.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.84 0.856 . . . . 0.0 111.587 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.57 -1.93 69.7 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 123.172 0.295 . . . . 0.0 113.143 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.8 mt -59.07 112.24 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.525 0.73 . . . . 0.0 110.939 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -58.0 138.1 56.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.281 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -146.71 148.84 32.41 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 118.719 0.69 . . . . 0.0 112.658 -172.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -114.18 122.96 48.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.007 1.323 . . . . 0.0 108.978 170.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.41 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -91.48 137.06 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.178 0.591 . . . . 0.0 110.007 173.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -122.15 137.18 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.776 1.63 . . . . 0.0 107.817 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.8 mt . . . . . 0 CA--C 1.547 0.828 0 C-N-CA 122.756 0.423 . . . . 0.0 110.242 175.871 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.0 p . . . . . 0 N--CA 1.47 0.546 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.421 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -99.99 146.25 26.93 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -110.09 124.93 52.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.559 HG12 HD22 ' A' ' 25' ' ' LEU . 71.9 mt -98.41 129.76 48.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.686 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 173.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -152.15 -179.71 7.76 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 46.7 ttt180 -144.28 95.59 5.5 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 176.069 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo . . . . . 0 C--N 1.366 1.477 0 C-N-CA 123.082 2.521 . . . . 0.0 112.842 -163.735 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.5 m . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 110.537 -0.171 . . . . 0.0 110.537 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -86.62 136.7 32.95 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.448 0.699 . . . . 0.0 109.153 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.7 t -101.61 139.42 22.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.912 173.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.559 HD22 HG12 ' A' ' 5' ' ' ILE . 2.8 tm? -117.81 104.55 11.07 Favored 'General case' 0 C--N 1.343 0.326 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -107.47 134.32 50.68 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.628 -1.169 . . . . 0.0 107.886 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.4 p90 . . . . . 0 N--CA 1.471 0.58 0 C-N-CA 123.651 0.78 . . . . 0.0 109.555 176.919 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 33.3 m . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.6 pttt -144.87 155.88 43.7 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 121.597 0.713 . . . . 0.0 112.73 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.436 HD13 HD13 ' A' ' 25' ' ' LEU . 43.0 mt -125.39 160.4 29.48 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.74 1.616 . . . . 0.0 108.342 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 15.5 p -118.84 129.41 55.2 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.552 0.741 . . . . 0.0 109.795 172.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.15 147.31 50.55 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.79 1.636 . . . . 0.0 108.169 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -67.28 -31.36 71.62 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.615 0.766 . . . . 0.0 111.227 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 55.2 p -132.41 160.45 36.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.077 0.951 . . . . 0.0 110.112 -177.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -60.45 -40.87 92.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.375 0.67 . . . . 0.0 110.481 171.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -47.33 -47.21 25.82 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 124.497 1.123 . . . . 0.0 112.717 177.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -69.65 -31.03 68.87 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 122.967 0.507 . . . . 0.0 111.761 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.34 -42.99 34.53 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.561 0.744 . . . . 0.0 111.599 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -69.86 -42.68 73.18 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.894 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.65 -32.62 71.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.23 0.612 . . . . 0.0 111.474 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -64.68 -60.01 3.6 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 123.228 0.611 . . . . 0.0 109.533 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.94 -50.22 69.4 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.68 1.192 . . . . 0.0 112.332 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -59.57 -42.24 92.01 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.976 0.91 . . . . 0.0 111.566 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -62.22 -30.57 71.18 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.646 1.178 . . . . 0.0 110.931 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -87.88 -19.53 27.24 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.274 0.63 . . . . 0.0 111.058 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.04 -2.89 66.47 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 112.845 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 45.6 mt -67.14 108.56 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.172 0 CA-C-O 121.274 0.559 . . . . 0.0 110.537 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.44 140.77 57.08 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.845 171.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.421 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 34.5 p90 -142.31 151.63 42.16 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 118.633 0.651 . . . . 0.0 112.032 -169.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -120.42 115.49 23.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.247 1.019 . . . . 0.0 108.441 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -81.83 133.45 29.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.069 0.547 . . . . 0.0 111.1 177.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.02 136.9 51.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 125.721 1.608 . . . . 0.0 107.477 174.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.5 mt . . . . . 0 CA--C 1.546 0.801 0 C-N-CA 123.214 0.606 . . . . 0.0 110.875 179.026 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 2' ' ' SER . . . . . 0.422 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 14.6 t . . . . . 0 N--CA 1.482 1.129 0 CA-C-O 120.856 0.36 . . . . 0.0 111.257 . . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.404 ' HB1' HD13 ' A' ' 25' ' ' LEU . . . -100.21 137.33 38.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.256 1.022 . . . . 0.0 110.394 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.433 ' HZ2' ' HB3' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -108.55 119.98 41.09 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 108.042 175.113 . . . . . . . . 3 3 . 1 . 010 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.0 mp -105.56 123.5 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 175.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.9 p90 -156.07 172.7 17.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -136.19 96.97 12.33 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.088 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo . . . . . 0 C--N 1.36 1.159 0 C-N-CA 122.186 1.924 . . . . 0.0 112.217 -173.047 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -75.07 123.06 24.52 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 67.8 t -101.48 138.37 25.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.509 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 52.4 tp -116.06 105.31 12.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 173.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.521 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 16.1 mt-10 -106.58 137.85 43.84 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 172.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.3 p90 . . . . . 0 CA--C 1.502 -0.875 0 CA-C-N 117.571 0.169 . . . . 0.0 110.779 177.736 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m . . . . . 0 C--O 1.241 0.652 0 CA-C-O 121.056 0.455 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.521 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 3.6 ptpp? -133.21 135.77 45.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.792 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.505 HD12 HD23 ' A' ' 25' ' ' LEU . 42.4 mt -117.47 142.91 46.59 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -114.68 128.95 56.59 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -134.56 156.64 48.31 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.254 1.022 . . . . 0.0 110.133 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -65.14 -31.3 72.42 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.001 0.813 . . . . 0.0 111.466 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 49.6 p -135.62 164.06 28.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.412 0.685 . . . . 0.0 110.965 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.89 -41.73 87.85 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.75 169.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -49.83 -45.74 50.54 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.922 1.389 . . . . 0.0 111.474 -174.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -72.19 -30.03 64.56 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.046 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.509 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . . . -79.48 -40.59 29.4 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.227 0.611 . . . . 0.0 111.067 -176.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -70.78 -39.58 73.1 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.936 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.22 -36.77 66.32 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.739 0.816 . . . . 0.0 112.5 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -66.59 -55.91 13.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.019 0.528 . . . . 0.0 110.299 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.79 -47.09 64.36 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.437 1.095 . . . . 0.0 112.056 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -59.45 -45.24 92.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.091 0.956 . . . . 0.0 111.647 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.5 ttt180 -54.09 -39.39 66.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.737 1.215 . . . . 0.0 111.309 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.98 -27.0 36.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.434 0.694 . . . . 0.0 111.432 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 98.3 1.51 58.03 Favored Glycine 0 C--N 1.349 1.263 0 O-C-N 123.216 0.323 . . . . 0.0 112.592 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.9 mt -69.35 107.25 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 CA-C-O 121.403 0.621 . . . . 0.0 110.201 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.4 pt-20 -54.04 143.94 20.72 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.018 170.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -147.36 149.25 32.43 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.501 1.046 . . . . 0.0 113.026 -168.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -110.76 125.94 54.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.484 1.114 . . . . 0.0 109.928 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 92.4 t -89.89 118.59 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 173.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 77.1 mt -122.6 117.34 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.03 1.332 . . . . 0.0 108.444 -174.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 80.2 mt . . . . . 0 CA--C 1.548 0.9 0 C-N-CA 124.045 0.938 . . . . 0.0 112.239 -174.273 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.8 m . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.5 155.38 24.24 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 113.132 0.789 . . . . 0.0 113.132 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -113.05 123.73 50.97 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.062 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.418 HG12 ' HG ' ' A' ' 25' ' ' LEU . 89.9 mt -105.22 127.36 59.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 174.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -148.69 176.5 10.31 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 123.369 0.668 . . . . 0.0 109.434 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -140.72 95.72 7.77 Favored Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 173.806 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo . . . . . 0 C--N 1.361 1.206 0 C-N-CA 122.968 2.446 . . . . 0.0 114.607 -163.924 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.5 m . . . . . 0 N--CA 1.476 0.874 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.4 m95 -86.64 125.93 34.17 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.3 t -100.52 136.23 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.418 ' HG ' HG12 ' A' ' 5' ' ' ILE . 5.5 tt -116.07 108.37 16.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 178.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -107.05 135.0 49.35 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 175.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.0 p90 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -175.025 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.4 p . . . . . 0 CA--C 1.552 1.04 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 5.3 ptpp? -135.4 140.79 45.23 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.316 0.579 . . . . 0.0 111.833 -173.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.4 mp -120.47 153.12 37.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.988 1.315 . . . . 0.0 107.887 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.1 p -118.11 133.52 55.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.866 0.466 . . . . 0.0 110.634 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -133.84 147.18 51.17 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.108 1.363 . . . . 0.0 108.512 -177.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.411 ' HB2' HE22 ' A' ' 60' ' ' GLN . 30.7 mm-40 -71.07 -24.53 62.34 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -172.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 81.1 p -136.78 163.2 31.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.647 0.779 . . . . 0.0 109.736 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -64.51 -36.28 83.7 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.757 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -51.0 -48.93 61.25 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.912 0.885 . . . . 0.0 111.613 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.411 HE22 ' HB2' ' A' ' 56' ' ' GLU . 48.7 mt-30 -69.29 -29.36 67.22 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.319 -176.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.4 -41.51 32.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.17 0.588 . . . . 0.0 110.994 177.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.512 ' O ' ' HG3' ' A' ' 66' ' ' GLN . 13.0 pt-20 -77.43 -44.47 28.98 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.426 -169.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.14 69.02 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.414 1.086 . . . . 0.0 112.16 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -64.07 -54.7 29.99 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 172.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.5 -44.87 81.11 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.473 1.109 . . . . 0.0 111.944 178.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . 0.512 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 73.1 mt-30 -60.74 -44.28 96.87 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.105 0.962 . . . . 0.0 110.636 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -62.26 -31.07 71.59 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.005 1.322 . . . . 0.0 111.01 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -87.19 -22.16 25.46 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.051 0.94 . . . . 0.0 110.745 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.29 -1.31 72.96 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.704 -172.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.28 109.86 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-O 121.501 0.667 . . . . 0.0 110.357 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.17 133.94 53.87 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 113.793 -1.549 . . . . 0.0 108.102 171.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 55.7 p90 -140.38 152.68 45.95 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.611 -0.681 . . . . 0.0 110.927 -171.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 tpt85 -118.16 116.46 26.87 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 171.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.9 m -82.28 132.35 31.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-O 121.457 0.646 . . . . 0.0 110.69 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 mp -114.4 136.15 51.91 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 CA--C 1.545 0.776 0 C-N-CA 123.339 0.656 . . . . 0.0 111.863 -178.052 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.449 ' HB2' HD12 ' A' ' 25' ' ' LEU . . . -100.93 136.95 39.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.946 0.898 . . . . 0.0 109.738 -177.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -115.28 125.29 53.12 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 mp -105.37 121.82 57.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -147.62 172.3 14.25 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.411 ' HD2' ' NE1' ' A' ' 23' ' ' TRP . 38.7 ttt-85 -139.4 94.29 9.6 Favored Pre-proline 0 C--O 1.24 0.567 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 177.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo . . . . . 0 C--N 1.37 1.707 0 C-N-CA 122.866 2.378 . . . . 0.0 113.537 -168.987 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.411 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 77.1 m95 -77.5 116.05 17.76 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 177.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.495 HG22 HG22 ' A' ' 54' ' ' THR . 40.5 t -100.48 139.59 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.449 HD12 ' HB2' ' A' ' 3' ' ' ALA . 47.8 tp -116.24 106.08 13.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -114.94 133.14 56.26 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.4 p90 . . . . . 0 CA--C 1.505 -0.752 0 C-N-CA 123.807 0.843 . . . . 0.0 109.443 179.285 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.9 m . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -143.82 142.22 30.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.803 0.811 . . . . 0.0 112.28 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.31 159.96 23.96 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.324 1.85 . . . . 0.0 107.281 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.495 HG22 HG22 ' A' ' 24' ' ' VAL . 25.1 p -125.76 131.38 52.52 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.718 0.407 . . . . 0.0 110.743 177.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -129.44 153.61 47.77 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.176 1.391 . . . . 0.0 109.137 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -70.62 -25.56 63.08 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.008 0.523 . . . . 0.0 112.097 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 71.3 p -134.15 162.56 31.79 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.986 0.422 . . . . 0.0 111.033 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -58.48 -44.56 89.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.863 170.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -54.22 -43.64 70.98 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.652 1.22 . . . . 0.0 112.207 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.07 -30.58 66.75 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.083 0.553 . . . . 0.0 111.813 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . 0.42 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . . . -80.41 -38.54 30.04 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.299 0.571 . . . . 0.0 110.859 -177.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -76.34 -37.36 57.43 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.099 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.06 73.34 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.77 0.828 . . . . 0.0 111.722 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -65.8 -51.3 60.18 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.37 74.01 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.383 1.073 . . . . 0.0 111.515 175.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -63.65 -42.94 98.06 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.389 1.076 . . . . 0.0 111.63 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -55.77 -36.83 67.77 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.899 1.279 . . . . 0.0 110.735 175.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.419 ' HB2' HG13 ' A' ' 70' ' ' ILE . 35.0 mmtp -88.62 -19.21 26.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.458 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.27 -3.33 66.33 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-O 119.967 -0.352 . . . . 0.0 112.992 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.419 HG13 ' HB2' ' A' ' 68' ' ' LYS . 22.1 mt -61.61 109.58 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 123.05 0.54 . . . . 0.0 109.569 -178.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.05 139.06 42.55 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 113.544 -1.662 . . . . 0.0 108.79 171.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -140.52 147.4 39.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.414 1.006 . . . . 0.0 112.005 -169.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -122.34 136.67 54.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.841 1.257 . . . . 0.0 108.439 169.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 m -105.69 138.23 31.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.131 0.572 . . . . 0.0 110.246 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.87 136.39 57.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.01 1.724 . . . . 0.0 107.029 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 85.6 mt . . . . . 0 CA--C 1.549 0.934 0 C-N-CA 123.384 0.674 . . . . 0.0 111.345 179.91 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.4 p . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.447 ' HB2' HD13 ' A' ' 25' ' ' LEU . . . -99.69 135.65 40.79 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.529 0.732 . . . . 0.0 109.948 -176.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -108.19 126.81 53.22 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.485 ' HB ' HG11 ' A' ' 74' ' ' VAL . 57.0 mt -107.32 120.98 59.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.625 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 173.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -144.86 173.1 12.15 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -141.38 94.38 7.62 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo . . . . . 0 C--N 1.364 1.369 0 C-N-CA 123.365 2.71 . . . . 0.0 113.021 -169.964 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.4 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 20.9 m . . . . . 0 N--CA 1.481 1.102 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -85.15 121.71 28.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -177.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.483 HG23 HG23 ' A' ' 54' ' ' THR . 53.1 t -100.21 136.53 31.18 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.447 HD13 ' HB2' ' A' ' 3' ' ' ALA . 56.2 tp -116.77 106.28 13.31 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.878 1.271 . . . . 0.0 108.336 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -112.38 133.7 54.33 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.4 p90 . . . . . 0 N--CA 1.474 0.739 0 CA-C-N 118.372 0.533 . . . . 0.0 110.87 -177.34 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.471 0.607 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -137.55 147.69 45.34 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.927 0.87 . . . . 0.0 112.309 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.94 156.69 29.11 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 113.721 -1.581 . . . . 0.0 107.136 176.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.483 HG23 HG23 ' A' ' 24' ' ' VAL . 12.2 p -122.76 128.6 50.69 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.419 0.554 . . . . 0.0 110.372 176.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.4 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 97.9 m-85 -128.62 152.15 48.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.379 1.472 . . . . 0.0 108.534 -178.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -65.96 -33.63 76.27 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.888 0.375 . . . . 0.0 111.302 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 65.1 p -134.33 159.32 41.37 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.52 0.728 . . . . 0.0 110.694 -173.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -58.45 -44.84 89.35 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.54 1.136 . . . . 0.0 111.419 174.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -50.36 -43.11 54.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.322 . . . . 0.0 112.798 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -70.99 -31.68 68.29 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.013 0.525 . . . . 0.0 111.964 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.53 -40.31 57.16 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.78 0.432 . . . . 0.0 111.088 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -72.45 -33.87 67.35 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.773 177.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.2 -41.25 75.29 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.08 0.552 . . . . 0.0 111.427 173.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -67.08 -58.79 4.22 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 123.314 0.645 . . . . 0.0 110.387 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -50.85 -51.48 50.95 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.79 1.236 . . . . 0.0 112.744 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -63.6 -40.02 95.86 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.698 0.799 . . . . 0.0 111.816 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -54.45 -37.15 64.85 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.615 1.166 . . . . 0.0 110.855 174.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.542 ' HB2' HG13 ' A' ' 70' ' ' ILE . 33.0 mmtp -90.43 -20.06 23.19 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.497 0.719 . . . . 0.0 111.686 -178.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.57 1.86 60.28 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-O 119.891 -0.394 . . . . 0.0 113.14 -176.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.542 HG13 ' HB2' ' A' ' 68' ' ' LYS . 10.7 mt -64.25 108.71 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-O 120.956 0.408 . . . . 0.0 110.439 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -56.43 139.2 49.78 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.152 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -148.14 153.09 38.37 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.794 0.724 . . . . 0.0 111.179 -170.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . 0.424 ' NH1' HG13 ' A' ' 75' ' ' ILE . 6.2 tmm_? -133.92 146.81 50.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 169.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.485 HG11 ' HB ' ' A' ' 5' ' ' ILE . 19.8 m -106.36 140.91 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.746 0.784 . . . . 0.0 111.747 -173.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.424 HG13 ' NH1' ' A' ' 73' ' ' ARG . 3.3 mp -109.35 141.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 125.803 1.641 . . . . 0.0 107.088 173.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.6 mt . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 122.761 0.424 . . . . 0.0 111.531 179.171 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 p . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.63 137.12 39.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.909 0.484 . . . . 0.0 111.189 -166.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.85 132.11 54.45 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.493 HG23 ' HG3' ' A' ' 58' ' ' GLN . 40.2 mt -112.57 123.98 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.45 175.29 12.0 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -136.74 97.17 11.45 Favored Pre-proline 0 N--CA 1.479 0.992 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo . . . . . 0 C--N 1.371 1.717 0 C-N-CA 123.253 2.635 . . . . 0.0 112.638 -170.745 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.445 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 16.8 m . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 . . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -86.94 130.32 34.51 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -177.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.1 t -101.29 137.54 28.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 54.2 tp -115.27 105.09 12.47 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 177.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -118.58 130.17 55.74 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.2 p90 . . . . . 0 N--CA 1.475 0.786 0 CA-C-N 118.401 0.546 . . . . 0.0 111.561 -173.875 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 C--O 1.241 0.625 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.61 150.48 37.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.336 1.065 . . . . 0.0 113.361 -173.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -121.68 159.15 27.14 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 113.532 -1.667 . . . . 0.0 107.599 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 p -122.28 129.87 52.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.081 0.953 . . . . 0.0 110.309 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.455 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 94.9 m-85 -130.54 148.93 52.4 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.268 1.427 . . . . 0.0 108.171 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.99 -29.65 70.07 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 120.906 0.384 . . . . 0.0 110.477 -176.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.8 p -133.07 159.66 39.44 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.2 1.0 . . . . 0.0 110.134 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.493 ' HG3' HG23 ' A' ' 5' ' ' ILE . 41.0 tt0 -59.99 -41.17 91.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.7 0.8 . . . . 0.0 110.864 171.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -50.48 -45.57 56.37 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 124.559 1.162 . . . . 0.0 112.201 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.455 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 48.8 mt-30 -67.32 -32.54 73.57 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.178 0.591 . . . . 0.0 111.385 -178.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.18 -42.95 54.73 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.058 0.543 . . . . 0.0 111.459 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -75.08 -39.22 60.94 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.844 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.29 71.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.518 0.727 . . . . 0.0 111.661 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . 0.5 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 14.9 t80 -66.91 -56.64 9.39 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.83 -45.66 70.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.086 0.954 . . . . 0.0 112.529 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -62.03 -43.93 97.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.487 1.115 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -57.23 -34.52 68.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.703 1.201 . . . . 0.0 111.646 176.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.621 ' HB2' HG13 ' A' ' 70' ' ' ILE . 11.7 mmmm -92.22 -16.88 25.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.13 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 88.48 1.5 80.85 Favored Glycine 0 C--N 1.35 1.35 0 O-C-N 123.616 0.573 . . . . 0.0 112.849 -173.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.621 HG13 ' HB2' ' A' ' 68' ' ' LYS . 73.0 mt -57.95 114.94 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.259 0.623 . . . . 0.0 110.988 -179.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -57.61 131.2 49.51 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 113.942 -1.481 . . . . 0.0 108.543 169.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.7 p90 -144.01 147.97 34.61 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-O 121.272 0.558 . . . . 0.0 111.43 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -117.6 123.06 45.26 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.343 172.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.9 t -80.19 124.2 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 170.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -107.87 120.44 59.23 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 169.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.3 mt . . . . . 0 CA--C 1.544 0.748 0 O-C-N 123.185 0.303 . . . . 0.0 110.28 176.662 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 m . . . . . 0 N--CA 1.473 0.69 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.458 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -100.89 123.79 45.61 Favored 'General case' 0 C--O 1.218 -0.589 0 C-N-CA 123.146 0.578 . . . . 0.0 109.899 -172.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -107.18 119.26 38.91 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 91.5 mt -105.09 121.19 56.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.432 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.7 p90 -152.15 177.49 10.47 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.7 ttt180 -143.52 97.5 5.52 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.623 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo . . . . . 0 C--N 1.371 1.745 0 C-N-CA 122.675 2.25 . . . . 0.0 112.085 -174.913 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 C--O 1.246 0.914 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -85.3 133.39 34.15 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.3 t -102.31 137.24 30.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 2.8 tt -115.72 106.61 14.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 175.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -116.89 131.17 57.02 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 -177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.458 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 43.1 p90 . . . . . 0 C--O 1.242 0.698 0 C-N-CA 123.334 0.654 . . . . 0.0 110.522 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 . . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.402 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 14.5 ptpt -137.75 133.11 33.72 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.592 0.711 . . . . 0.0 112.233 -175.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.4 mp -119.45 151.09 39.13 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.191 1.396 . . . . 0.0 107.652 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.2 p -118.26 132.54 56.3 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 118.564 0.62 . . . . 0.0 111.243 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -132.7 149.53 52.28 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.247 1.419 . . . . 0.0 108.938 -177.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -68.91 -28.19 66.45 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.936 0.494 . . . . 0.0 111.901 -176.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.0 p -134.64 162.14 33.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.442 0.697 . . . . 0.0 110.909 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.74 -43.0 98.46 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.622 0.769 . . . . 0.0 111.011 171.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -57.1 -37.5 72.03 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.225 0.953 . . . . 0.0 111.779 -175.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -72.91 -32.81 65.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.999 0.52 . . . . 0.0 111.442 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.73 -39.06 57.88 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 -177.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.11 -32.29 63.15 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.952 176.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.67 -37.91 66.33 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.359 0.663 . . . . 0.0 111.693 174.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -65.34 -59.78 3.67 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.643 0.777 . . . . 0.0 110.416 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.88 70.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.394 1.077 . . . . 0.0 112.767 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -63.01 -39.71 95.56 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.162 0.985 . . . . 0.0 111.287 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -53.82 -38.22 64.38 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.316 1.046 . . . . 0.0 111.322 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . 0.453 ' HB2' HG13 ' A' ' 70' ' ' ILE . 79.7 mttt -93.27 -18.03 22.94 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.921 -176.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.69 6.76 76.19 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.195 -172.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . 0.453 HG13 ' HB2' ' A' ' 68' ' ' LYS . 67.7 mt -60.5 113.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -56.62 129.97 43.26 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.111 -1.858 . . . . 0.0 108.666 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -141.17 140.23 34.0 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.692 -0.63 . . . . 0.0 111.746 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.2 tpp85 -104.74 122.99 46.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.692 1.197 . . . . 0.0 108.937 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.1 t -85.12 125.88 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.432 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.7 mp -108.41 125.35 65.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 C-N-CA 125.397 1.479 . . . . 0.0 107.107 170.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.7 mt . . . . . 0 CA--C 1.545 0.772 0 C-N-CA 122.288 0.235 . . . . 0.0 111.092 179.386 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.2 p . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.472 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -98.02 145.07 26.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.055 -172.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -113.84 125.28 53.9 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 168.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.501 ' HB ' HG11 ' A' ' 74' ' ' VAL . 91.6 mt -107.07 121.49 59.98 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . 0.428 ' HA ' ' O ' ' A' ' 75' ' ' ILE . 30.5 p90 -149.1 174.91 11.82 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -126.26 99.95 30.27 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 175.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . 0.413 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 72.3 Cg_endo . . . . . 0 C--N 1.368 1.578 0 C-N-CA 123.022 2.481 . . . . 0.0 112.865 -172.501 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.413 ' O ' ' HD2' ' A' ' 8' ' ' PRO . 27.0 m . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 . . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -87.96 125.89 34.76 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 118.819 0.736 . . . . 0.0 109.448 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 76.1 t -101.39 138.97 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 9.4 tt -115.22 107.21 14.99 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -116.37 130.4 56.75 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 p90 . . . . . 0 CA--C 1.509 -0.623 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 -175.955 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.5 t . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 13.2 ptmm? -131.88 136.82 47.72 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.223 171.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.3 mp -120.12 144.63 47.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 19.2 p -111.8 128.86 56.24 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.085 0.554 . . . . 0.0 109.806 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -125.3 156.56 38.45 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 125.05 1.34 . . . . 0.0 108.943 -178.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.36 -42.0 97.99 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.246 1.018 . . . . 0.0 111.696 177.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.0 p -136.5 168.11 20.1 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 124.013 0.925 . . . . 0.0 110.014 -173.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -63.33 -37.38 87.04 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.484 173.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -58.55 -41.24 85.15 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 124.148 0.905 . . . . 0.0 111.815 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -70.36 -29.51 66.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.978 0.511 . . . . 0.0 111.817 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.72 -41.22 38.56 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.088 0.555 . . . . 0.0 110.747 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.52 -38.66 65.25 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.648 -177.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.78 -36.12 73.91 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 0.0 112.02 172.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -64.61 -58.26 6.82 Favored 'General case' 0 C--N 1.349 0.548 0 O-C-N 123.68 0.612 . . . . 0.0 110.011 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.55 -50.06 66.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.607 1.163 . . . . 0.0 112.382 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -60.59 -42.33 96.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.672 0.789 . . . . 0.0 111.163 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -61.93 -30.34 70.84 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.773 1.229 . . . . 0.0 111.152 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.61 -14.29 26.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.291 0.636 . . . . 0.0 111.274 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.39 2.03 83.13 Favored Glycine 0 C--N 1.351 1.374 0 O-C-N 123.15 0.281 . . . . 0.0 113.018 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.1 mt -62.23 111.91 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 CA-C-O 121.522 0.677 . . . . 0.0 111.121 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -61.23 133.31 55.78 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 113.434 -1.712 . . . . 0.0 108.528 169.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 53.7 p90 -138.77 143.59 39.03 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.055 0.843 . . . . 0.0 112.652 -171.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -110.19 110.57 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.912 1.285 . . . . 0.0 108.567 173.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.501 HG11 ' HB ' ' A' ' 5' ' ' ILE . 27.3 m -83.88 128.94 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . 0.428 ' O ' ' HA ' ' A' ' 6' ' ' TYR . 4.2 mp -119.55 126.37 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 172.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.3 mt . . . . . 0 CA--C 1.546 0.811 0 CA-C-O 119.298 -0.382 . . . . 0.0 110.247 177.984 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 p . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.83 139.24 36.8 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.328 0.651 . . . . 0.0 110.111 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . 0.504 ' HZ3' ' HB3' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -107.46 127.32 53.5 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.451 . . . . . . . . 3 3 . 1 . 017 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.452 HG22 ' HG3' ' A' ' 58' ' ' GLN . 61.1 mt -107.09 122.94 61.87 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -147.19 176.58 9.86 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.6 ttt180 -141.52 96.02 7.05 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 175.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo . . . . . 0 C--N 1.365 1.44 0 C-N-CA 122.842 2.361 . . . . 0.0 112.754 -170.66 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . 0.439 HG21 ' HB ' ' A' ' 54' ' ' THR . 3.6 m . . . . . 0 C--O 1.244 0.782 0 CA-C-O 121.139 0.495 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -84.06 122.21 28.48 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . 0.493 HG21 HG22 ' A' ' 54' ' ' THR . 56.0 t -100.93 138.72 24.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.53 -177.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -117.43 105.06 11.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -117.11 130.18 56.46 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.3 p90 . . . . . 0 CA--C 1.51 -0.577 0 C-N-CA 123.105 0.562 . . . . 0.0 110.224 -177.28 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 120.963 0.411 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -146.17 142.84 28.85 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.164 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp -116.77 158.58 23.66 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.819 1.648 . . . . 0.0 108.106 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' THR . . . . . 0.493 HG22 HG21 ' A' ' 24' ' ' VAL . 17.0 p -122.84 133.87 54.42 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.656 0.782 . . . . 0.0 110.973 175.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . 0.404 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 98.8 m-85 -135.15 153.06 52.11 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.277 1.031 . . . . 0.0 109.897 -178.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . 0.419 ' HB2' HE22 ' A' ' 60' ' ' GLN . 6.2 mm-40 -62.85 -32.42 73.64 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.26 0.624 . . . . 0.0 111.356 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 34.6 p -135.5 162.11 33.6 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.734 0.814 . . . . 0.0 111.127 -174.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . 0.452 ' HG3' HG22 ' A' ' 5' ' ' ILE . 41.6 tt0 -58.43 -41.9 86.09 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.705 170.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -49.36 -47.7 47.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.137 1.375 . . . . 0.0 112.563 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . 0.419 HE22 ' HB2' ' A' ' 56' ' ' GLU . 50.9 mt-30 -69.32 -30.73 68.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.458 0.703 . . . . 0.0 111.7 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.6 -42.51 51.73 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.893 0.477 . . . . 0.0 111.139 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -72.18 -39.27 68.78 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.455 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.37 74.96 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 122.775 0.43 . . . . 0.0 111.956 176.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -66.13 -56.58 10.73 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.26 -48.71 68.03 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.468 1.107 . . . . 0.0 111.903 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -64.66 -40.42 95.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.821 0.848 . . . . 0.0 111.514 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -56.09 -35.51 67.11 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.928 1.291 . . . . 0.0 111.081 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -85.75 -23.11 27.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.789 0.836 . . . . 0.0 110.844 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.56 -0.75 65.7 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-O 120.089 -0.284 . . . . 0.0 112.415 -172.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 50.9 mt -65.44 108.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.09 139.75 40.45 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.173 -1.831 . . . . 0.0 108.74 169.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -136.58 145.59 45.13 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 118.866 0.757 . . . . 0.0 111.657 -171.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -118.21 130.0 55.82 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.703 1.201 . . . . 0.0 108.438 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 48.6 t -102.43 132.52 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 121.81 67.81 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.9 mt . . . . . 0 CA--C 1.545 0.761 0 C-N-CA 122.777 0.431 . . . . 0.0 111.265 -179.592 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.85 127.62 44.83 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -169.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -109.5 122.1 46.66 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.488 HG13 HD22 ' A' ' 25' ' ' LEU . 3.6 mp -103.6 119.79 52.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 42.8 p90 -143.84 176.45 9.24 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . 0.431 ' HD2' ' NE1' ' A' ' 23' ' ' TRP . 78.2 ttt180 -142.68 100.81 5.53 Favored Pre-proline 0 C--N 1.314 -0.954 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 C--N 1.368 1.568 0 C-N-CA 122.089 1.859 . . . . 0.0 110.625 -177.193 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.245 0.864 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . 0.431 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 66.4 m95 -90.35 131.83 35.92 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.856 0.862 . . . . 0.0 109.039 -176.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -100.08 139.3 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.257 177.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.488 HD22 HG13 ' A' ' 5' ' ' ILE . 3.4 tm? -111.34 105.2 13.78 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 175.001 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . 0.617 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 1.8 tm-20 -116.25 124.44 50.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 -174.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.6 p90 . . . . . 0 N--CA 1.472 0.66 0 CA-C-N 119.317 0.962 . . . . 0.0 111.667 -174.835 . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 32.1 m . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 120.941 0.4 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.617 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 4.5 ptpp? -133.72 142.7 48.08 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.234 1.016 . . . . 0.0 112.356 -171.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . 0.462 HD13 HD13 ' A' ' 25' ' ' LEU . 48.9 mt -118.56 154.0 33.31 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.944 1.698 . . . . 0.0 107.213 177.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 p -121.36 130.91 53.88 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.06 0.845 . . . . 0.0 110.134 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -129.1 153.49 47.61 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.836 1.655 . . . . 0.0 108.549 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -67.0 -32.9 74.45 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.789 0.436 . . . . 0.0 111.835 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.5 p -134.69 160.61 37.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.415 0.686 . . . . 0.0 111.226 -175.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -58.84 -45.53 89.84 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.224 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -50.42 -42.43 53.87 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.635 1.174 . . . . 0.0 112.831 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -71.26 -30.89 66.85 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.173 0.589 . . . . 0.0 112.17 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.41 -39.79 24.41 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.413 0.685 . . . . 0.0 111.188 -178.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -76.37 -39.87 52.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 114.636 -1.165 . . . . 0.0 111.229 -178.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.91 -25.88 65.71 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.423 0.689 . . . . 0.0 111.599 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -65.36 -52.44 53.68 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.05 -46.47 75.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.089 0.956 . . . . 0.0 111.415 176.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -58.73 -47.44 84.59 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.424 1.09 . . . . 0.0 111.222 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.0 ttm-85 -59.46 -32.46 70.26 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.136 1.375 . . . . 0.0 111.576 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -94.54 -12.2 28.04 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.422 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.97 -4.97 81.94 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-O 119.921 -0.377 . . . . 0.0 112.732 -178.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.44 113.65 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.947 0 C-N-CA 123.656 0.782 . . . . 0.0 110.883 -177.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -55.82 134.17 51.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 113.433 -1.712 . . . . 0.0 108.648 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -143.06 149.8 38.69 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 118.237 0.471 . . . . 0.0 110.81 -174.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -133.51 141.17 47.63 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 171.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.434 HG13 ' HB ' ' A' ' 5' ' ' ILE . 18.0 m -103.86 139.97 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-O 121.131 0.491 . . . . 0.0 111.18 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.4 mp -109.29 121.94 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 171.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 mt . . . . . 0 CA--C 1.55 0.979 0 C-N-CA 122.77 0.428 . . . . 0.0 111.169 -179.232 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 108.193 -1.039 . . . . 0.0 108.193 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.94 156.15 24.44 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -173.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -113.0 126.36 55.42 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.924 1.29 . . . . 0.0 109.099 164.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.1 mt -103.21 129.6 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 171.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -154.03 -179.14 7.6 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 123.857 0.863 . . . . 0.0 109.552 176.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -141.39 99.36 6.43 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 106.957 -1.497 . . . . 0.0 106.957 174.254 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 C--N 1.368 1.572 0 C-N-CA 122.713 2.275 . . . . 0.0 112.523 -172.021 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.1 p . . . . . 0 C--O 1.245 0.844 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -75.93 125.8 29.8 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -173.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 90.9 t -102.07 139.22 23.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.11 105.97 13.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 169.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -104.32 133.35 49.36 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.9 p90 . . . . . 0 N--CA 1.474 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.019 -175.278 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -144.14 148.33 34.91 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.93 0.871 . . . . 0.0 113.263 -167.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.7 mp -120.99 155.65 33.83 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.85 -1.523 . . . . 0.0 107.855 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -118.15 130.66 56.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.348 0.659 . . . . 0.0 110.252 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.75 153.05 48.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.358 1.463 . . . . 0.0 109.206 -175.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -72.01 -29.86 64.63 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.187 0.595 . . . . 0.0 111.745 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.9 p -136.44 163.42 30.52 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.431 0.692 . . . . 0.0 110.758 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -57.5 -44.58 85.12 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.796 0.838 . . . . 0.0 110.615 172.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . 0.48 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 41.8 mt-10 -56.61 -39.09 72.99 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 124.677 1.235 . . . . 0.0 111.969 -174.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -64.04 -39.66 94.57 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.484 0.714 . . . . 0.0 111.541 175.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.4 -40.05 62.27 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.302 0.641 . . . . 0.0 111.768 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . 0.48 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.7 pt-20 -76.82 -43.01 38.18 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.135 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.99 -27.21 65.49 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 123.168 0.587 . . . . 0.0 111.431 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -64.21 -54.31 35.48 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 172.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.33 -48.41 74.22 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.586 1.154 . . . . 0.0 111.833 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -60.7 -43.9 97.21 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.421 1.088 . . . . 0.0 111.432 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -64.0 -28.1 69.58 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.587 1.155 . . . . 0.0 111.552 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.87 -13.53 27.1 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.264 0.626 . . . . 0.0 111.116 177.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.02 -1.12 82.8 Favored Glycine 0 C--N 1.354 1.529 0 O-C-N 123.332 0.395 . . . . 0.0 113.252 -176.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.8 mt -63.17 110.67 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.294 0 CA-C-O 121.836 0.827 . . . . 0.0 110.807 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -65.68 137.28 57.21 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.352 -1.749 . . . . 0.0 109.137 171.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -140.44 149.76 42.98 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.669 0.668 . . . . 0.0 112.486 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -108.52 111.59 23.53 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.164 0.986 . . . . 0.0 109.5 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 76.7 t -79.64 118.22 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.477 0.711 . . . . 0.0 109.819 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 27.6 mt -122.86 97.48 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.438 1.495 . . . . 0.0 107.495 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.8 mt . . . . . 0 CA--C 1.554 1.109 0 C-N-CA 123.264 0.626 . . . . 0.0 112.386 -173.831 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 3' ' ' ALA . . . . . 0.476 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.28 128.84 47.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.234 0.614 . . . . 0.0 109.998 -174.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -109.04 123.79 49.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 176.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 5' ' ' ILE . . . . . 0.512 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.7 mp -109.17 121.14 61.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -148.42 170.87 17.05 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -172.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -139.36 96.3 8.86 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 C--N 1.371 1.76 0 C-N-CA 122.488 2.125 . . . . 0.0 112.023 -173.351 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.48 1.057 0 CA-C-O 120.588 0.232 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -88.79 129.1 35.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.414 1.085 . . . . 0.0 108.86 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -101.35 137.28 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.423 ' HG ' HG13 ' A' ' 5' ' ' ILE . 5.6 tt -112.45 108.56 17.74 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 175.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -114.14 132.7 55.98 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' PHE . . . . . 0.476 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 3.3 p90 . . . . . 0 C--O 1.241 0.643 0 CA-C-O 121.555 0.693 . . . . 0.0 112.615 -178.318 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.2 t . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' LYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 6.5 ptpp? -138.8 134.48 33.46 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.331 172.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.24 159.88 18.87 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.952 1.301 . . . . 0.0 107.749 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -125.82 129.82 50.16 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.17 0.509 . . . . 0.0 110.118 170.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -127.04 150.36 49.48 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.547 1.539 . . . . 0.0 108.734 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -72.43 -26.15 61.74 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.412 0.685 . . . . 0.0 111.763 -176.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.1 p -130.34 159.78 35.93 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.453 0.701 . . . . 0.0 109.619 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -62.71 -39.26 93.47 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.495 171.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -55.33 -41.12 72.02 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.367 1.042 . . . . 0.0 111.874 -176.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -68.21 -32.78 73.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.099 0.56 . . . . 0.0 111.395 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.45 -41.44 21.82 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.506 0.723 . . . . 0.0 111.326 -175.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.39 -38.91 74.76 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.843 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.36 71.09 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.159 0.584 . . . . 0.0 112.078 175.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -63.33 -59.15 5.09 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.73 73.7 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.12 0.968 . . . . 0.0 111.662 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -65.86 -42.65 90.16 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.178 0.991 . . . . 0.0 111.799 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -55.66 -38.34 69.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.566 1.146 . . . . 0.0 110.684 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -80.77 -26.41 37.27 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.823 0.849 . . . . 0.0 110.754 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.86 -5.26 69.07 Favored Glycine 0 C--N 1.349 1.301 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.541 -169.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.68 112.13 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-O 121.437 0.637 . . . . 0.0 110.644 -178.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.95 135.34 36.82 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 113.149 -1.841 . . . . 0.0 108.821 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -143.04 145.93 33.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.428 0.558 . . . . 0.0 111.207 -170.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -125.64 114.01 18.14 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' VAL . . . . . 0.512 HG12 ' HB ' ' A' ' 5' ' ' ILE . 24.5 m -84.53 139.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.92 0.488 . . . . 0.0 111.077 177.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.83 126.29 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.469 1.508 . . . . 0.0 107.412 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.8 mt . . . . . 0 CA--C 1.551 0.983 0 C-N-CA 122.927 0.491 . . . . 0.0 110.535 177.943 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.411 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.8 mpt? . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 . . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.6 p -106.87 124.0 48.98 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.99 0.516 . . . . 0.0 110.776 -175.955 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.5 ' HB2' HD13 ' A' ' 25' ' ' LEU . . . -102.6 127.53 49.65 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.844 0.858 . . . . 0.0 109.172 175.734 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.402 ' HB2' HD13 ' A' ' 75' ' ' ILE . 17.2 ptpt -108.72 124.23 50.23 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -177.833 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.464 HG13 HD11 ' A' ' 25' ' ' LEU . 4.0 mp -107.87 121.24 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.473 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.9 p90 -150.59 160.05 44.08 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.429 0.633 . . . . 0.0 112.132 -173.483 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.58 ' HB2' ' HB3' ' A' ' 77' ' ' PRO . 11.9 mtp180 -122.16 96.61 46.3 Favored Pre-proline 0 N--CA 1.478 0.97 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 168.256 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.551 ' HG2' ' HA ' ' A' ' 11' ' ' THR . 73.1 Cg_endo -74.8 165.34 31.68 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 122.623 2.215 . . . . 0.0 111.676 178.297 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.71 -41.19 99.02 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.72 0.808 . . . . 0.0 110.466 177.881 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -112.72 112.26 23.64 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 107.678 -1.231 . . . . 0.0 107.678 170.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.551 ' HA ' ' HG2' ' A' ' 8' ' ' PRO . 7.8 p -93.29 154.55 17.93 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.685 0.794 . . . . 0.0 111.948 -170.682 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.03 96.54 0.62 Allowed 'General case' 0 C--N 1.354 0.769 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 171.251 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.439 ' HA ' ' HB3' ' A' ' 18' ' ' ALA . 57.2 mtt -73.11 -25.48 60.88 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.101 -174.899 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 56.73 87.93 0.05 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.016 1.326 . . . . 0.0 111.095 174.735 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.1 t 63.71 17.41 10.43 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 124.165 0.986 . . . . 0.0 111.314 -174.928 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.22 28.85 73.15 Favored Glycine 0 C--N 1.354 1.568 0 CA-C-N 115.957 -0.565 . . . . 0.0 113.787 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 76.4 p -82.71 -41.83 18.8 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.743 0.417 . . . . 0.0 111.561 -177.76 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.439 ' HB3' ' HA ' ' A' ' 13' ' ' MET . . . -66.61 134.89 53.25 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.593 0.757 . . . . 0.0 111.515 -177.318 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -93.68 -72.08 0.63 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.798 0.839 . . . . 0.0 109.559 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 30.0 p -81.43 -179.82 7.53 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 123.671 0.788 . . . . 0.0 110.354 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.43 ' HB2' ' NH2' ' A' ' 7' ' ' ARG . 13.3 m120 -66.97 92.21 0.23 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.344 0.592 . . . . 0.0 109.832 176.437 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.7 p -71.06 153.19 8.4 Favored 'Isoleucine or valine' 0 C--O 1.249 1.076 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.169 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.407 ' CH2' ' HD3' ' A' ' 77' ' ' PRO . 75.7 m95 -82.51 125.43 31.11 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 177.284 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.9 t -100.07 135.97 33.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.5 HD13 ' HB2' ' A' ' 3' ' ' ALA . 51.2 tp -116.37 104.0 11.03 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.6 tt0 -104.97 135.92 45.41 Favored 'General case' 0 C--O 1.214 -0.772 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 176.841 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -142.62 153.68 43.7 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.559 0.618 . . . . 0.0 111.876 -178.642 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -61.42 86.84 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.025 165.612 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.463 ' HB2' HG23 ' A' ' 51' ' ' VAL . . . -77.67 111.92 13.95 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 115.007 -0.997 . . . . 0.0 109.284 177.597 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.77 113.12 8.47 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.734 -177.183 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 p -103.59 95.96 8.08 Favored Pre-proline 0 CA--C 1.556 1.179 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 167.027 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.97 -163.57 0.13 Allowed 'Trans proline' 0 C--N 1.38 2.226 0 C-N-CA 123.314 2.676 . . . . 0.0 113.11 -171.629 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -61.06 98.03 0.07 Allowed 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 122.446 1.117 . . . . 0.0 110.236 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -149.34 80.37 1.4 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.0 1.32 . . . . 0.0 108.545 -169.11 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.9 pp -82.41 154.42 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.917 173.705 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -85.38 132.01 46.26 Favored Pre-proline 0 N--CA 1.474 0.746 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.875 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -59.76 -27.15 84.27 Favored 'Trans proline' 0 C--N 1.372 1.78 0 C-N-CA 122.939 2.426 . . . . 0.0 113.469 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.3 mm -74.66 -42.2 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 121.338 0.59 . . . . 0.0 109.856 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 57.7 mtt -85.72 -18.57 32.71 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.557 -174.199 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.31 -124.66 30.24 Favored Glycine 0 C--N 1.349 1.282 0 O-C-N 123.463 0.477 . . . . 0.0 112.349 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -73.84 105.8 5.28 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 173.044 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 t -125.51 103.66 8.0 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.746 0.818 . . . . 0.0 109.975 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.5 t -68.12 -20.56 64.93 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.602 0.761 . . . . 0.0 110.584 173.162 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.4 t -76.44 78.27 3.16 Favored 'General case' 0 C--N 1.355 0.818 0 CA-C-O 121.838 0.828 . . . . 0.0 109.569 174.665 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.0 t -165.36 93.91 0.61 Allowed 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -62.93 148.32 47.78 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.304 0.642 . . . . 0.0 110.013 -176.201 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.425 ' N ' ' SD ' ' A' ' 47' ' ' MET . 1.1 mpt? -50.84 -59.35 4.21 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.635 1.174 . . . . 0.0 112.194 -170.444 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.3 175.46 9.38 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.943 0.897 . . . . 0.0 109.393 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -138.12 148.93 45.45 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.551 1.14 . . . . 0.0 108.689 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -108.18 87.57 2.53 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 122.009 0.909 . . . . 0.0 110.347 -174.844 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.463 HG23 ' HB2' ' A' ' 29' ' ' ALA . 15.6 m -95.56 166.52 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.525 -0.734 . . . . 0.0 109.614 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -142.9 149.28 38.26 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-O 122.025 0.917 . . . . 0.0 113.437 -173.44 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.408 HD11 HD23 ' A' ' 25' ' ' LEU . 50.5 mt -119.2 158.9 25.06 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.522 1.929 . . . . 0.0 107.588 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.1 p -122.31 129.05 51.78 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 118.43 0.559 . . . . 0.0 110.622 175.049 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -130.63 148.53 52.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.258 1.423 . . . . 0.0 108.936 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.09 -22.36 62.11 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.771 0.428 . . . . 0.0 111.579 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.3 p -132.47 157.21 45.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.217 0.607 . . . . 0.0 111.169 178.17 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -58.82 -43.85 90.71 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.276 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -59.05 -35.54 73.52 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.687 1.242 . . . . 0.0 111.494 -175.047 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -74.03 -30.02 62.21 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.076 0.551 . . . . 0.0 112.04 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.33 -37.83 31.79 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.366 0.603 . . . . 0.0 110.903 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -71.92 -37.71 70.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.368 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.39 70.61 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.645 0.778 . . . . 0.0 112.171 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -61.3 -60.3 3.94 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.073 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.99 -47.69 64.76 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.973 1.309 . . . . 0.0 112.046 -177.761 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -60.81 -46.47 90.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.369 1.068 . . . . 0.0 111.341 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.7 ttt85 -63.36 -31.81 73.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.588 1.155 . . . . 0.0 111.396 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.21 -14.81 35.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.177 0.591 . . . . 0.0 111.462 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.04 -3.4 76.93 Favored Glycine 0 C--N 1.35 1.348 0 C-N-CA 122.823 0.249 . . . . 0.0 112.789 -176.336 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 59.3 mt -69.29 106.46 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.122 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -55.1 143.88 25.65 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.397 170.528 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -135.8 146.84 47.97 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.61 0.641 . . . . 0.0 112.116 -170.836 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -114.36 125.36 53.78 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 171.249 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 90.9 t -90.45 126.73 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 110.16 175.393 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.473 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 mp -105.93 112.39 39.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 170.381 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.67 153.64 50.76 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 123.633 0.773 . . . . 0.0 111.665 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.58 ' HB3' ' HB2' ' A' ' 7' ' ' ARG . 47.2 Cg_endo -64.16 169.09 11.23 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 122.702 2.268 . . . . 0.0 112.839 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.21 30.44 0.18 Allowed 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.411 1.084 . . . . 0.0 112.214 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.579 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 9.3 pt-20 -159.23 6.21 0.1 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.164 1.386 . . . . 0.0 110.391 -169.939 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.064 0 C-N-CA 123.587 0.755 . . . . 0.0 111.601 -175.149 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.531 ' SD ' ' HB3' ' A' ' 30' ' ' GLU . 52.4 ttp . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 . . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.8 p -130.59 119.26 22.23 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 177.258 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.442 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.49 134.59 44.35 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.87 0.468 . . . . 0.0 110.908 -167.629 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.56 122.82 48.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 176.882 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.501 ' HB ' HG12 ' A' ' 74' ' ' VAL . 5.1 mp -107.21 122.57 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -147.78 172.99 13.24 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -175.46 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.485 ' O ' ' HB3' ' A' ' 77' ' ' PRO . 27.5 ttp180 -116.48 119.99 35.31 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 170.086 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.496 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 29.6 Cg_endo -59.59 97.38 0.1 Allowed 'Trans proline' 0 CA--C 1.55 1.319 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 177.807 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.51 -8.82 40.35 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.493 165.233 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.25 30.81 4.65 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.882 1.273 . . . . 0.0 109.833 170.042 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 m -45.45 132.47 7.99 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.423 1.489 . . . . 0.0 113.418 -163.021 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.99 143.81 30.9 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 124.335 1.022 . . . . 0.0 110.608 176.063 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 83.8 mtp -59.5 113.91 2.44 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 123.951 0.782 . . . . 0.0 110.929 -174.072 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -68.04 82.71 0.22 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.124 0.97 . . . . 0.0 110.165 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.4 t -85.96 -69.64 0.65 Allowed 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.531 0.732 . . . . 0.0 109.829 -176.818 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -100.79 25.63 27.61 Favored Glycine 0 C--N 1.346 1.128 0 CA-C-N 116.297 -0.411 . . . . 0.0 112.245 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.8 t -151.62 171.08 18.19 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.864 0.866 . . . . 0.0 109.569 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -155.9 32.1 0.35 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.135 0.974 . . . . 0.0 109.279 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm -68.12 141.59 56.04 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.348 -177.201 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 46.0 p -67.6 153.96 42.52 Favored 'General case' 0 C--O 1.244 0.772 0 O-C-N 124.093 0.871 . . . . 0.0 110.473 177.223 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -75.68 98.5 4.09 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.828 0.823 . . . . 0.0 111.442 -169.98 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.496 ' O ' ' HD2' ' A' ' 8' ' ' PRO . 28.8 m -96.59 -174.69 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.172 175.232 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.7 m95 -93.11 132.75 36.96 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.39 0.676 . . . . 0.0 109.319 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.465 HG23 HG22 ' A' ' 54' ' ' THR . 70.3 t -102.54 138.66 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 tt -112.99 108.26 17.1 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -119.94 131.15 55.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.594 ' HE2' ' HG3' ' A' ' 30' ' ' GLU . 35.0 p90 -144.74 158.4 43.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.522 0.729 . . . . 0.0 111.058 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.23 122.27 20.79 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 168.405 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.484 ' HB2' ' HB3' ' A' ' 48' ' ' LYS . . . -59.19 152.51 20.4 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -160.837 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.594 ' HG3' ' HE2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -100.84 14.11 32.8 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.501 175.272 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -65.39 118.26 48.64 Favored Pre-proline 0 CA--C 1.556 1.184 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.783 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.79 -164.74 0.28 Allowed 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 122.555 2.17 . . . . 0.0 112.96 -172.491 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -58.0 -28.94 64.87 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.848 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -76.83 79.99 3.42 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.215 1.006 . . . . 0.0 109.611 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 64.9 mt -98.89 140.03 19.39 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 170.136 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.54 124.52 62.8 Favored Pre-proline 0 CA--C 1.542 0.649 0 C-N-CA 124.218 1.007 . . . . 0.0 111.537 -175.956 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.1 -19.37 40.9 Favored 'Trans proline' 0 C--N 1.377 2.048 0 C-N-CA 123.353 2.702 . . . . 0.0 112.777 175.271 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.4 mm -58.68 -48.47 85.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 124.476 1.111 . . . . 0.0 110.312 173.1 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 63.0 mtt -77.5 -37.26 51.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.247 0.619 . . . . 0.0 110.349 174.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.62 124.99 0.75 Allowed Glycine 0 C--N 1.337 0.601 0 N-CA-C 110.386 -1.085 . . . . 0.0 110.386 -178.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -74.4 90.67 2.18 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.4 p -87.58 140.06 29.91 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.967 -173.867 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.9 m -73.86 -33.35 64.06 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.16 162.92 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.5 t 67.09 82.14 0.19 Allowed 'General case' 0 C--N 1.354 0.789 0 C-N-CA 125.411 1.484 . . . . 0.0 111.461 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 32.0 t -97.26 -14.81 21.13 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 114.999 -1.001 . . . . 0.0 109.609 170.172 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -100.37 167.25 10.52 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.292 1.037 . . . . 0.0 110.773 -175.25 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -88.37 175.97 7.4 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.483 0.713 . . . . 0.0 111.588 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.484 ' HB3' ' HB2' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -93.06 130.36 38.69 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.189 -169.957 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.13 173.68 5.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.906 0.882 . . . . 0.0 110.736 177.537 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.67 152.92 26.88 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.575 0.702 . . . . 0.0 111.024 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.8 m -140.17 147.53 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 CA-C-N 114.327 -1.306 . . . . 0.0 109.435 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.5 136.03 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.676 0.75 . . . . 0.0 111.363 -175.444 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.5 mp -123.81 153.91 40.33 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.591 1.556 . . . . 0.0 107.448 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.465 HG22 HG23 ' A' ' 24' ' ' VAL . 17.1 p -120.54 125.18 47.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.381 0.991 . . . . 0.0 111.154 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -124.44 145.49 49.47 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.905 1.682 . . . . 0.0 107.448 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -69.99 -22.63 63.12 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -172.933 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 45.1 p -135.72 162.38 32.93 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 110.146 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -61.64 -40.93 96.66 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.57 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -59.49 -39.54 84.09 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.713 0.805 . . . . 0.0 111.585 -175.007 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 49.1 mt-30 -67.7 -33.21 74.45 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.936 0.495 . . . . 0.0 111.337 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.03 -39.68 25.43 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.148 0.499 . . . . 0.0 111.046 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.38 -39.0 63.0 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.305 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.29 -32.34 73.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.485 0.714 . . . . 0.0 111.76 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -66.69 -49.25 66.7 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.16 84.07 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.094 0.958 . . . . 0.0 111.187 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -62.64 -42.96 99.89 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.957 0.903 . . . . 0.0 111.324 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -55.48 -36.74 66.94 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.965 1.306 . . . . 0.0 110.825 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -87.09 -21.0 26.3 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.041 -0.982 . . . . 0.0 110.882 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.62 -10.68 66.74 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.265 -0.742 . . . . 0.0 112.536 -174.503 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.453 HG12 ' SD ' ' A' ' 1' ' ' MET . 52.7 mt -52.63 114.3 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.818 0.847 . . . . 0.0 111.512 -173.224 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -58.14 130.4 46.44 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 113.861 -1.518 . . . . 0.0 108.739 170.274 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -142.16 146.64 35.53 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.045 0.45 . . . . 0.0 111.509 -169.875 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -114.86 133.81 55.66 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.683 1.193 . . . . 0.0 107.797 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.501 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.7 m -103.32 127.48 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-O 121.389 0.614 . . . . 0.0 109.426 174.545 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.26 132.25 68.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 C-N-CA 125.432 1.493 . . . . 0.0 107.282 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 34.4 mt -75.27 149.37 84.48 Favored Pre-proline 0 C--O 1.24 0.564 0 O-C-N 122.997 0.186 . . . . 0.0 110.573 173.84 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.584 ' HB2' ' HG2' ' A' ' 79' ' ' GLU . 48.7 Cg_endo -67.89 158.88 55.36 Favored 'Trans proline' 0 C--N 1.37 1.684 0 C-N-CA 122.063 1.842 . . . . 0.0 111.269 174.929 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -27.18 69.11 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.668 0.387 . . . . 0.0 110.677 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.584 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 17.0 pt-20 -71.15 -28.27 64.15 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.2 1.0 . . . . 0.0 111.27 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.356 0.849 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 176.707 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.564 ' SD ' ' NZ ' ' A' ' 48' ' ' LYS . 7.7 mmt . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.417 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 50.4 m -125.66 117.23 23.06 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.11 136.41 41.0 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.965 0.506 . . . . 0.0 109.716 -173.935 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -108.24 123.55 48.95 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.46 HG12 HD12 ' A' ' 25' ' ' LEU . 59.3 mt -104.29 121.04 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.225 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -146.59 176.63 9.68 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.701 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 60.3 ttt180 -136.41 94.62 13.55 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.075 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -91.32 -158.5 0.07 OUTLIER 'Trans proline' 0 C--N 1.368 1.587 0 C-N-CA 123.483 2.789 . . . . 0.0 111.559 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.52 12.81 10.08 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 172.241 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -80.51 -15.19 57.3 Favored 'General case' 0 C--N 1.349 0.558 0 C-N-CA 125.532 1.533 . . . . 0.0 111.142 -176.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.2 p -61.2 94.51 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.119 0.968 . . . . 0.0 110.452 174.997 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.76 -176.3 5.32 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.07 0.948 . . . . 0.0 110.521 177.85 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.406 ' HA ' ' HB2' ' A' ' 18' ' ' ALA . 57.7 mtm -67.09 87.23 0.15 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.916 0.487 . . . . 0.0 109.792 179.752 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -92.65 109.24 20.65 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.4 t 61.88 23.74 14.01 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 124.278 1.031 . . . . 0.0 110.316 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.79 -41.33 2.2 Favored Glycine 0 C--N 1.353 1.522 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.603 -177.746 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.0 t -77.43 135.08 38.26 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.284 0.634 . . . . 0.0 111.802 -172.085 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.406 ' HB2' ' HA ' ' A' ' 13' ' ' MET . . . -169.32 11.81 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.536 1.134 . . . . 0.0 111.409 -177.906 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -63.18 -33.45 75.49 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.358 0.663 . . . . 0.0 111.247 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.1 p -113.04 130.87 56.0 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 124.06 0.944 . . . . 0.0 108.73 173.015 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -78.46 102.29 7.75 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 172.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.8 m -79.71 -179.41 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 123.316 0.647 . . . . 0.0 111.547 -177.13 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -84.88 129.54 34.79 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.9 t -102.74 138.49 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.396 0.617 . . . . 0.0 109.739 175.988 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.46 HD12 HG12 ' A' ' 5' ' ' ILE . 60.4 tp -116.06 105.49 12.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -114.41 131.11 56.7 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -146.67 157.05 43.62 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.236 1.014 . . . . 0.0 110.713 178.21 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -69.56 128.42 36.42 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 106.126 -1.805 . . . . 0.0 106.126 164.459 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.456 ' HB2' ' O ' ' A' ' 49' ' ' GLN . . . -52.43 141.42 19.92 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -164.933 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.451 ' HA ' ' HE3' ' A' ' 1' ' ' MET . 8.7 pt-20 -80.5 48.02 1.0 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.53 1.132 . . . . 0.0 110.522 177.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -114.13 130.53 23.84 Favored Pre-proline 0 CA--C 1.548 0.901 0 O-C-N 122.018 -0.426 . . . . 0.0 110.139 -172.741 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -82.82 -148.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.365 1.417 0 C-N-CA 122.49 2.126 . . . . 0.0 110.298 164.574 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.9 ppt_? -82.8 50.7 1.74 Allowed 'General case' 0 CA--C 1.558 1.276 0 CA-C-O 121.424 0.63 . . . . 0.0 110.242 167.986 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -80.95 72.85 7.98 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 123.992 0.917 . . . . 0.0 109.461 -175.782 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.569 HD12 ' HA ' ' A' ' 42' ' ' THR . 6.1 pt -144.81 145.15 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.904 1.282 . . . . 0.0 108.709 -173.145 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.403 ' HB2' ' HG3' ' A' ' 39' ' ' MET . 2.9 m-20 -109.58 156.0 40.37 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 123.314 0.646 . . . . 0.0 110.904 -177.411 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -59.5 -34.44 97.04 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 122.57 2.18 . . . . 0.0 111.136 171.73 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.22 -37.95 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.102 0.961 . . . . 0.0 110.612 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.403 ' HG3' ' HB2' ' A' ' 36' ' ' ASP . 64.0 mtt -67.14 -35.37 79.57 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.498 0.719 . . . . 0.0 111.426 179.353 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.35 18.55 76.91 Favored Glycine 0 C--N 1.347 1.157 0 O-C-N 123.619 0.575 . . . . 0.0 112.922 -177.258 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -104.62 26.43 9.07 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.873 0.869 . . . . 0.0 109.179 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.569 ' HA ' HD12 ' A' ' 35' ' ' ILE . 20.0 p -81.37 -30.33 33.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.799 0.84 . . . . 0.0 112.453 -174.884 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.9 t -67.53 -44.71 77.7 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.263 0.554 . . . . 0.0 109.595 175.136 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.0 m -91.13 71.67 6.3 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.474 175.545 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 22.9 t -70.55 94.21 0.97 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.397 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -71.15 121.69 18.79 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.941 -174.147 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 54.7 mtt -88.05 -43.4 11.74 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.65 0.78 . . . . 0.0 110.677 -176.516 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.564 ' NZ ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -172.49 86.46 0.07 Allowed 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 121.601 0.715 . . . . 0.0 111.045 178.501 . . . . . . . . 3 3 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.456 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 25.5 pt20 -74.5 141.95 44.85 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 171.628 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -70.6 133.59 46.85 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.627 -0.67 . . . . 0.0 109.751 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.0 m -137.45 149.63 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-N 114.68 -1.145 . . . . 0.0 109.087 -173.374 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -142.62 136.25 28.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.631 0.729 . . . . 0.0 111.377 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.4 mp -121.64 147.59 45.66 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 113.866 -1.516 . . . . 0.0 107.2 -178.295 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.4 p -113.16 132.55 55.43 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.261 0.624 . . . . 0.0 110.186 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.475 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.7 m-85 -132.85 148.24 52.3 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.298 1.439 . . . . 0.0 108.509 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.0 mt-10 -70.15 -26.75 64.08 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 123.283 0.364 . . . . 0.0 111.915 -177.72 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 58.6 p -133.17 163.27 29.66 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.05 0.54 . . . . 0.0 110.096 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -62.13 -39.1 91.42 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 114.959 -1.018 . . . . 0.0 110.828 171.263 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -53.06 -43.16 66.47 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.473 1.109 . . . . 0.0 111.469 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.475 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 64.3 mt-30 -67.74 -36.25 80.21 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.064 0.945 . . . . 0.0 111.395 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.03 -39.7 55.1 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.973 0.509 . . . . 0.0 111.127 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -70.85 -37.48 73.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.562 177.007 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.37 -38.72 69.21 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.523 0.729 . . . . 0.0 111.925 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -63.39 -60.62 3.14 Favored 'General case' 0 C--N 1.351 0.64 0 C-N-CA 123.325 0.65 . . . . 0.0 110.005 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.41 -47.41 66.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.489 1.115 . . . . 0.0 112.293 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -61.9 -45.8 92.17 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.006 0.922 . . . . 0.0 111.452 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -59.72 -34.37 72.84 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.081 0.952 . . . . 0.0 110.936 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -86.87 -20.56 27.26 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.333 0.653 . . . . 0.0 111.407 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.18 2.05 74.73 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 116.643 -0.253 . . . . 0.0 112.786 -173.842 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.97 110.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 122.568 0.347 . . . . 0.0 110.179 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.417 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.6 pt-20 -58.58 136.93 57.71 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 124.95 1.407 . . . . 0.0 108.407 170.494 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -144.42 151.52 39.36 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.357 0.526 . . . . 0.0 110.997 -171.906 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.449 ' NH1' HG13 ' A' ' 75' ' ' ILE . 3.5 tmt_? -125.44 140.34 52.86 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.516 1.127 . . . . 0.0 108.26 171.4 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -105.57 136.84 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.352 0.661 . . . . 0.0 111.032 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.449 HG13 ' NH1' ' A' ' 73' ' ' ARG . 2.3 mp -111.26 150.47 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.4 mt -74.67 154.87 87.38 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 122.841 0.457 . . . . 0.0 110.987 173.959 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.701 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 40.8 Cg_endo -64.35 169.47 10.92 Favored 'Trans proline' 0 C--N 1.379 2.169 0 C-N-CA 123.317 2.678 . . . . 0.0 114.336 -177.404 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.53 -19.96 65.91 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.729 0.812 . . . . 0.0 111.438 172.061 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.549 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 11.4 pt-20 -96.96 10.95 37.7 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.24 1.016 . . . . 0.0 111.15 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.354 0.771 0 C-N-CA 122.963 0.505 . . . . 0.0 110.632 -178.979 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 mmt . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.9 m -116.77 133.71 55.69 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.035 0.534 . . . . 0.0 111.197 -172.291 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -102.31 144.39 30.86 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -107.71 124.92 50.73 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.589 HG23 ' HG2' ' A' ' 58' ' ' GLN . 70.3 mt -103.28 123.71 56.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.315 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 172.073 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -148.46 176.22 10.49 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.347 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.582 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 60.2 ttt180 -141.68 97.52 6.59 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 174.099 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -73.13 157.72 50.18 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.715 1.61 . . . . 0.0 111.714 -176.108 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.85 -31.41 66.64 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.48 173.758 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -136.08 116.18 13.38 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.536 1.134 . . . . 0.0 109.063 173.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.404 ' HG1' HG22 ' A' ' 20' ' ' THR . 30.2 p -74.72 -24.21 58.7 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.392 0.677 . . . . 0.0 110.642 175.983 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -162.44 -160.37 0.65 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.983 1.313 . . . . 0.0 107.521 176.424 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 62.8 mtt -67.4 110.67 3.68 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 171.341 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.445 ' HB3' ' HZ3' ' A' ' 19' ' ' LYS . 29.3 mm-40 -117.25 59.87 0.76 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.68 0.792 . . . . 0.0 111.411 -171.784 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.6 p -144.27 114.8 7.63 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.029 0.532 . . . . 0.0 110.072 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.75 23.6 61.82 Favored Glycine 0 C--N 1.348 1.231 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.493 -177.294 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.0 t -142.32 177.19 8.43 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.669 0.787 . . . . 0.0 110.062 -176.066 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.85 132.54 53.4 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.416 0.687 . . . . 0.0 111.266 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.445 ' HZ3' ' HB3' ' A' ' 14' ' ' GLN . 9.6 mmpt? -74.79 87.46 2.24 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.404 HG22 ' HG1' ' A' ' 11' ' ' THR . 13.2 t -101.5 31.28 3.83 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.536 -179.846 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -71.53 76.6 0.79 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.267 1.027 . . . . 0.0 110.076 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.7 m -119.73 -170.58 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.022 1.329 . . . . 0.0 109.8 -176.295 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -85.17 132.17 34.33 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.6 t -101.06 139.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.13 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.509 HD22 HG12 ' A' ' 5' ' ' ILE . 3.4 tm? -116.84 104.6 11.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -107.81 137.48 45.75 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -124.44 159.75 29.77 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.174 0.59 . . . . 0.0 109.9 -178.887 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.502 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 29.0 t70 -97.98 93.65 6.43 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 -177.917 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.51 ' HB1' HG11 ' A' ' 31' ' ' VAL . . . -59.46 134.95 57.48 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.197 178.872 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -91.21 31.26 1.14 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.634 0.774 . . . . 0.0 110.758 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.51 HG11 ' HB1' ' A' ' 29' ' ' ALA . 9.2 p -133.77 112.41 12.59 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 122.915 0.486 . . . . 0.0 110.2 -169.81 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.633 ' HA ' ' H ' ' A' ' 48' ' ' LYS . 77.4 Cg_endo -78.69 -154.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.378 2.086 0 C-N-CA 123.306 2.67 . . . . 0.0 112.143 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.506 ' HG3' ' HD3' ' A' ' 34' ' ' LYS . 28.7 ptt180 -44.8 -29.62 0.82 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.903 1.281 . . . . 0.0 114.158 178.081 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . 0.506 ' HD3' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -73.82 82.75 1.64 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.643 0.377 . . . . 0.0 110.348 178.091 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 80.9 mt -129.27 158.97 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 125.247 1.419 . . . . 0.0 108.342 177.762 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -41.01 131.72 1.91 Allowed Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 124.964 1.306 . . . . 0.0 112.097 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -57.86 -19.1 37.7 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 123.335 2.69 . . . . 0.0 113.364 -176.335 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.0 mm -64.17 -39.46 85.57 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 C-N-CA 124.511 1.124 . . . . 0.0 111.106 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -137.94 23.74 2.83 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.666 0.787 . . . . 0.0 111.055 -173.331 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -120.06 -52.51 0.26 Allowed Glycine 0 N--CA 1.47 0.953 0 CA-C-O 120.059 -0.301 . . . . 0.0 113.566 -171.103 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -58.98 100.85 0.08 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.482 0.713 . . . . 0.0 110.913 -177.308 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.722 ' HA ' ' HB2' ' A' ' 45' ' ' SER . 81.9 p 68.22 -22.23 0.13 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 126.86 2.064 . . . . 0.0 114.366 174.89 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 t -73.4 -19.91 60.87 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.82 0.848 . . . . 0.0 110.061 170.691 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 51.4 m -136.52 56.04 1.82 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.479 1.112 . . . . 0.0 108.705 174.174 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.722 ' HB2' ' HA ' ' A' ' 42' ' ' THR . 23.1 t -87.64 35.03 0.71 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.895 0.878 . . . . 0.0 110.683 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -132.72 166.43 22.23 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.028 0.931 . . . . 0.0 110.074 -175.989 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.2 pmm? -83.77 111.15 18.92 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.383 175.085 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.633 ' H ' ' HA ' ' A' ' 32' ' ' PRO . 84.5 mttt 70.43 110.34 0.06 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.936 1.294 . . . . 0.0 111.791 170.115 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -89.48 101.95 14.63 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 121.043 0.449 . . . . 0.0 110.53 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.502 ' HG3' ' HA ' ' A' ' 28' ' ' ASP . 26.7 mp0 -76.37 88.38 3.16 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.391 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.88 164.2 2.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 C-N-CA 124.551 1.14 . . . . 0.0 108.498 -174.768 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -137.44 146.54 44.47 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.772 0.796 . . . . 0.0 111.628 -173.723 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp -119.61 157.27 28.77 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.978 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 48.5 p -121.73 131.6 54.17 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 110.193 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -128.17 147.49 50.56 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.503 1.521 . . . . 0.0 107.982 178.587 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.05 -24.21 64.15 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.656 0.382 . . . . 0.0 111.84 -176.736 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 79.8 p -132.99 160.5 36.96 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 123.927 0.891 . . . . 0.0 110.193 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.589 ' HG2' HG23 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -60.88 -40.41 92.91 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.078 0.951 . . . . 0.0 110.317 170.803 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -57.3 -39.7 76.32 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.75 1.22 . . . . 0.0 111.754 -174.573 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -70.93 -30.78 67.19 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 122.963 0.505 . . . . 0.0 112.013 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.2 -40.08 53.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.202 0.601 . . . . 0.0 111.14 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -37.59 67.2 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.951 177.724 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.78 77.24 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.244 0.618 . . . . 0.0 111.98 173.342 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -65.61 -59.33 4.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.532 0.733 . . . . 0.0 110.384 176.904 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.28 -49.52 69.42 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.544 1.138 . . . . 0.0 112.583 -177.949 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -64.18 -37.84 88.9 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.402 0.681 . . . . 0.0 111.73 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -62.17 -30.96 71.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.929 0.892 . . . . 0.0 110.692 175.891 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -85.92 -21.93 27.7 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.496 0.718 . . . . 0.0 110.629 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.6 -1.75 62.08 Favored Glycine 0 C--N 1.35 1.354 0 O-C-N 123.321 0.388 . . . . 0.0 112.722 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 26.8 mt -68.11 109.34 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-O 121.601 0.715 . . . . 0.0 110.144 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -58.08 141.34 50.38 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.772 169.02 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -141.12 149.86 42.11 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.146 0.43 . . . . 0.0 111.391 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -120.97 127.65 52.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.747 0.819 . . . . 0.0 109.494 172.955 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.41 HG21 HD11 ' A' ' 5' ' ' ILE . 35.1 t -102.51 134.83 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 123.761 0.825 . . . . 0.0 108.872 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.9 mt -130.71 121.04 49.42 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -178.704 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.8 143.58 98.07 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 123.744 0.817 . . . . 0.0 112.032 -175.217 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.582 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 47.0 Cg_endo -71.24 -176.28 1.84 Allowed 'Trans proline' 0 C--N 1.369 1.654 0 C-N-CA 123.301 2.667 . . . . 0.0 112.969 176.302 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.08 13.94 0.61 Allowed 'General case' 0 CA--C 1.558 1.267 0 CA-C-N 114.446 -1.252 . . . . 0.0 112.982 179.147 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -142.26 -9.97 0.86 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 121.104 0.478 . . . . 0.0 111.067 -179.13 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.48 ' HB3' ' O ' ' A' ' 28' ' ' ASP . 1.9 mpt? . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -120.73 122.87 41.35 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.226 0.61 . . . . 0.0 110.96 -172.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.42 137.46 37.89 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.479 0.711 . . . . 0.0 109.224 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -112.81 123.69 50.89 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 mp -105.93 123.31 60.41 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 N-CA-C 106.779 -1.564 . . . . 0.0 106.779 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -150.88 174.53 12.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.224 1.01 . . . . 0.0 108.354 -177.748 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.624 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 59.2 ttt180 -139.73 98.08 7.98 Favored Pre-proline 0 C--O 1.242 0.688 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.497 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -80.74 174.91 10.56 Favored 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 122.707 2.271 . . . . 0.0 112.186 -175.823 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.25 -18.12 60.17 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.377 0.671 . . . . 0.0 111.035 177.434 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -148.12 125.37 11.52 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.588 1.155 . . . . 0.0 107.924 170.532 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.2 p -67.41 -79.48 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.255 0.622 . . . . 0.0 111.308 -176.903 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 177.11 -64.6 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.939 1.295 . . . . 0.0 107.634 -175.85 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -85.51 106.65 17.0 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.157 0.983 . . . . 0.0 108.839 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.41 ' HA ' ' OG1' ' A' ' 17' ' ' THR . 26.2 mm-40 -86.54 85.33 7.3 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.122 0.569 . . . . 0.0 110.722 -174.674 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 42.9 m -93.83 -75.34 0.51 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.999 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -116.93 19.6 12.02 Favored Glycine 0 C--N 1.351 1.383 0 C-N-CA 123.667 0.651 . . . . 0.0 111.72 174.183 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.41 ' OG1' ' HA ' ' A' ' 14' ' ' GLN . 74.1 p -80.01 -9.23 59.68 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.296 1.038 . . . . 0.0 111.963 -173.184 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.9 -23.92 61.56 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.184 0.594 . . . . 0.0 110.111 172.307 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -91.4 -64.7 1.09 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.642 0.777 . . . . 0.0 108.949 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.5 p -140.48 127.42 20.69 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.808 0.843 . . . . 0.0 110.334 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -78.09 161.39 27.45 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 121.39 0.614 . . . . 0.0 110.316 171.049 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m -117.19 -175.07 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.824 177.605 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -85.96 132.57 34.05 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -176.477 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.1 t -102.12 138.44 26.36 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.497 HD21 HD21 ' A' ' 53' ' ' LEU . 9.1 tt -114.82 107.81 15.92 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 172.727 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -108.7 134.84 50.88 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 174.852 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.4 ' CE2' ' HA ' ' A' ' 29' ' ' ALA . 2.1 p90 -145.29 154.33 42.23 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.546 0.612 . . . . 0.0 112.053 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.48 ' O ' ' HB3' ' A' ' 1' ' ' MET . 23.8 t70 -61.23 108.07 0.85 Allowed 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 106.97 -1.492 . . . . 0.0 106.97 162.49 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HA ' ' CE2' ' A' ' 27' ' ' PHE . . . -61.96 152.11 33.11 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -170.804 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.77 10.07 10.35 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.05 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.2 p -95.19 133.5 26.03 Favored Pre-proline 0 CA--C 1.555 1.171 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.408 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -54.49 171.26 0.44 Allowed 'Trans proline' 0 C--N 1.374 1.909 0 C-N-CA 123.38 2.72 . . . . 0.0 114.507 170.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -65.75 -14.33 61.1 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 115.002 -0.999 . . . . 0.0 112.093 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -71.69 109.29 5.5 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 123.935 0.894 . . . . 0.0 109.857 175.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 36.7 pt -94.02 162.36 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.843 0.857 . . . . 0.0 110.757 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -88.85 149.13 43.01 Favored Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 123.577 0.751 . . . . 0.0 109.142 178.505 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.41 -33.76 38.9 Favored 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 123.315 2.676 . . . . 0.0 114.17 173.735 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.4 mt -63.59 -42.28 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 C-N-CA 122.994 0.518 . . . . 0.0 110.122 178.151 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 82.9 mtp -61.27 -59.01 5.97 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.731 0.812 . . . . 0.0 109.893 178.221 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 63.14 24.95 67.67 Favored Glycine 0 CA--C 1.534 1.261 0 O-C-N 123.724 0.64 . . . . 0.0 114.409 175.139 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -84.09 68.12 9.96 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.723 0.809 . . . . 0.0 110.11 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 67.8 p -100.44 -5.56 26.93 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.586 0.754 . . . . 0.0 111.374 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.4 p -60.89 -50.26 74.13 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.726 0.811 . . . . 0.0 110.903 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.1 m -123.01 103.5 8.63 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.164 0.986 . . . . 0.0 108.638 173.693 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 31.7 p -70.72 87.17 0.68 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.542 0.737 . . . . 0.0 110.203 178.668 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -92.11 166.46 12.64 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.53 0.732 . . . . 0.0 109.435 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.0 mmt -68.81 -36.99 78.91 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.818 0.447 . . . . 0.0 110.955 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.35 156.26 0.95 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.176 0.991 . . . . 0.0 109.942 173.678 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.413 HE21 HG22 ' A' ' 51' ' ' VAL . 13.2 pt20 -69.79 106.71 3.22 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.466 173.213 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -66.82 90.83 0.18 Allowed 'General case' 0 CA--C 1.553 1.066 0 CA-C-O 121.282 0.563 . . . . 0.0 109.683 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.413 HG22 HE21 ' A' ' 49' ' ' GLN . 58.6 t -70.05 160.73 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.389 1.075 . . . . 0.0 111.546 -171.181 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.409 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.5 ptpt -133.69 132.43 40.65 Favored 'General case' 0 C--N 1.352 0.681 0 CA-C-O 121.771 0.796 . . . . 0.0 110.826 174.764 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.497 HD21 HD21 ' A' ' 25' ' ' LEU . 2.0 mm? -115.83 148.41 39.95 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.8 p -114.86 130.93 56.98 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.67 -0.644 . . . . 0.0 109.677 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -130.84 146.48 52.29 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.469 1.507 . . . . 0.0 108.32 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -68.63 -27.16 65.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.797 0.439 . . . . 0.0 112.169 -175.908 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.4 p -134.3 159.28 41.48 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.629 0.771 . . . . 0.0 110.352 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -56.33 -46.29 79.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.65 1.18 . . . . 0.0 111.4 172.115 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -51.19 -45.42 61.81 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 124.909 1.381 . . . . 0.0 111.992 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -70.85 -29.14 65.18 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.609 0.764 . . . . 0.0 111.774 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.66 -44.42 28.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.033 0.533 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.49 -37.75 74.27 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.649 -177.301 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.35 -36.35 75.55 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.403 0.681 . . . . 0.0 112.302 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -62.66 -57.13 12.11 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.254 0.621 . . . . 0.0 109.905 177.883 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.58 -47.74 66.66 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.494 1.117 . . . . 0.0 111.777 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -60.06 -45.92 91.26 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.248 1.019 . . . . 0.0 112.004 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -60.54 -31.0 70.12 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.147 . . . . 0.0 111.172 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -87.84 -21.03 25.27 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.621 0.769 . . . . 0.0 111.059 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.52 -3.8 63.67 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-O 119.984 -0.342 . . . . 0.0 112.628 -174.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 48.1 mt -63.14 108.89 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 CA-C-O 121.048 0.452 . . . . 0.0 109.873 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -57.73 139.99 52.55 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.489 172.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.0 p90 -142.18 147.8 37.19 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.851 0.751 . . . . 0.0 112.102 -168.476 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -121.04 110.4 16.2 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 175.065 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.4 t -83.73 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.6 mt -121.65 129.17 75.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 125.931 1.692 . . . . 0.0 108.04 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.6 mt -59.58 133.89 88.9 Favored Pre-proline 0 CA--C 1.541 0.633 0 O-C-N 123.321 0.388 . . . . 0.0 110.863 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.624 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 76.9 Cg_endo -76.76 172.71 15.72 Favored 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 122.856 2.37 . . . . 0.0 113.556 -175.983 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -26.94 68.76 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 114.473 -1.239 . . . . 0.0 112.21 177.227 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -77.79 -24.65 48.79 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.427 0.691 . . . . 0.0 111.366 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.088 0 C-N-CA 123.076 0.55 . . . . 0.0 110.964 178.285 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.425 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.444 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 20.1 t -118.31 130.02 55.79 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.809 0.444 . . . . 0.0 109.884 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.407 ' HB3' HD13 ' A' ' 25' ' ' LEU . . . -100.66 136.55 40.35 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.608 0.763 . . . . 0.0 109.712 178.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -108.84 120.1 41.49 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 107.197 -1.409 . . . . 0.0 107.197 175.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.438 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.2 mp -104.54 123.15 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 177.76 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -151.48 173.04 15.06 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -176.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.804 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 68.0 ttt180 -138.84 97.16 9.05 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.082 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.7 147.76 45.65 Favored 'Trans proline' 0 C--N 1.365 1.421 0 C-N-CA 122.285 1.99 . . . . 0.0 111.502 -175.119 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.11 -34.82 77.05 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.4 0.619 . . . . 0.0 109.604 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -96.72 85.87 3.94 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.294 175.142 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.5 p -95.2 -177.19 4.04 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.512 0.725 . . . . 0.0 109.884 172.474 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.88 140.35 58.86 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 170.962 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 43.3 mtm 67.41 32.4 5.83 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.834 1.254 . . . . 0.0 110.326 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -46.98 139.11 5.87 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 125.204 1.402 . . . . 0.0 112.627 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.8 t 82.45 -31.21 0.09 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 126.273 1.829 . . . . 0.0 111.569 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -108.36 17.99 33.5 Favored Glycine 0 C--N 1.35 1.341 0 N-CA-C 111.809 -0.516 . . . . 0.0 111.809 169.917 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.2 t -92.11 44.16 1.16 Allowed 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 124.608 1.163 . . . . 0.0 110.424 -173.887 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.13 103.44 0.47 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.39 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.69 -32.94 0.16 Allowed 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.726 1.61 . . . . 0.0 112.07 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.4 t -73.14 -1.99 19.74 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 122.947 0.499 . . . . 0.0 111.117 174.01 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -61.96 108.2 0.99 Allowed 'General case' 0 C--N 1.357 0.93 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 160.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.412 HG21 HG23 ' A' ' 54' ' ' THR . 9.6 m -130.36 -179.08 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.886 0.874 . . . . 0.0 110.938 -169.933 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.6 m95 -88.88 132.75 34.54 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.068 0.947 . . . . 0.0 109.338 -172.849 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.7 t -101.44 138.84 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.51 ' HB2' ' HB2' ' A' ' 61' ' ' ALA . 53.8 tp -114.42 106.69 14.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 125.369 1.468 . . . . 0.0 107.17 176.279 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -115.46 132.38 56.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -145.75 156.83 43.86 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 123.357 0.663 . . . . 0.0 110.592 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.9 115.43 7.42 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 168.777 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.409 ' HB1' ' HB2' ' A' ' 48' ' ' LYS . . . -54.99 128.3 32.91 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.152 0.908 . . . . 0.0 111.697 -171.2 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -70.83 -4.63 25.18 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.839 0.856 . . . . 0.0 112.417 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.23 138.35 75.31 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 123.114 0.565 . . . . 0.0 109.735 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.27 -174.72 1.27 Allowed 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 122.386 2.057 . . . . 0.0 110.841 167.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.462 ' HB3' ' HA ' ' A' ' 47' ' ' MET . 3.8 ppt_? -72.3 80.82 1.01 Allowed 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 122.548 1.166 . . . . 0.0 109.676 175.683 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -138.33 27.94 2.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.305 -1.316 . . . . 0.0 108.173 -177.087 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 35.0 pt -72.94 162.94 4.2 Favored 'Isoleucine or valine' 0 C--O 1.243 0.758 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.324 175.321 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -72.73 125.11 91.37 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.466 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.62 -10.71 27.11 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 122.484 2.123 . . . . 0.0 111.783 175.8 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.4 mm -65.56 -27.65 42.17 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 124.856 1.262 . . . . 0.0 110.543 175.141 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 63.7 mtt -66.8 -61.63 1.86 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.408 0.683 . . . . 0.0 110.512 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.91 -161.9 23.19 Favored Glycine 0 C--N 1.349 1.252 0 O-C-N 123.588 0.555 . . . . 0.0 113.642 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 59.07 20.64 8.53 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.955 1.302 . . . . 0.0 112.601 175.705 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.3 t -95.25 93.82 7.52 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.932 0.893 . . . . 0.0 109.446 -177.953 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.2 p -65.77 -29.36 69.85 Favored 'General case' 0 C--N 1.355 0.821 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.302 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 43.0 p -79.4 146.05 33.02 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.969 0.907 . . . . 0.0 110.277 174.211 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.5 m -74.29 79.11 1.83 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.307 0.643 . . . . 0.0 109.581 174.817 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -72.9 116.13 13.04 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.661 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.462 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . 50.0 ttm -97.39 -29.39 13.53 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 170.483 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HB2' ' HB1' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -162.53 153.13 16.98 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 124.622 1.169 . . . . 0.0 108.192 171.971 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -79.72 166.3 21.93 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.756 172.253 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -80.25 149.69 30.31 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 163.251 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 p -138.31 145.33 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -178.577 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -138.79 138.69 37.82 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.515 176.669 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp -119.18 151.71 37.86 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.412 HG23 HG21 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -122.88 128.45 50.36 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.644 0.657 . . . . 0.0 110.539 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -129.05 154.88 46.24 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.834 1.254 . . . . 0.0 108.999 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -67.8 -29.6 68.81 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.569 0.543 . . . . 0.0 111.874 -177.424 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 56.7 p -133.04 161.14 35.15 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 123.43 0.692 . . . . 0.0 111.079 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -54.63 -48.99 71.57 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.117 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -45.37 -46.16 12.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.08 1.752 . . . . 0.0 113.288 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -70.32 -33.82 71.96 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.11 0.564 . . . . 0.0 112.039 -178.476 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.51 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . . . -80.42 -38.06 30.93 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.305 0.574 . . . . 0.0 110.753 -174.286 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -72.1 -40.25 68.31 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.387 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.52 70.94 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.254 0.622 . . . . 0.0 112.118 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -63.81 -57.1 10.94 Favored 'General case' 0 C--N 1.352 0.695 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.468 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.89 -46.46 67.98 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.494 1.118 . . . . 0.0 112.223 177.809 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -60.12 -47.69 84.87 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.41 1.084 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -57.84 -36.28 72.08 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.779 1.232 . . . . 0.0 111.253 177.768 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -80.96 -25.38 37.41 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.594 0.758 . . . . 0.0 111.011 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.29 -5.55 63.0 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.032 0.349 . . . . 0.0 112.499 -171.362 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.72 110.62 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.343 0 C-N-CA 123.399 0.68 . . . . 0.0 110.79 -177.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.444 ' O ' ' HA ' ' A' ' 2' ' ' SER . 1.6 pm0 -54.19 138.91 37.24 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 113.645 -1.616 . . . . 0.0 109.343 169.992 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -148.21 151.2 35.1 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.0 0.818 . . . . 0.0 112.087 -170.241 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.488 HH11 HG13 ' A' ' 75' ' ' ILE . 1.2 tmt_? -121.56 125.71 47.41 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.091 0.956 . . . . 0.0 108.651 171.58 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.438 HG12 ' HB ' ' A' ' 5' ' ' ILE . 33.9 m -93.49 137.88 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.68 0.792 . . . . 0.0 110.315 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.488 HG13 HH11 ' A' ' 73' ' ' ARG . 4.1 mp -121.1 137.32 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.576 1.15 . . . . 0.0 108.325 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.1 mt -74.84 142.48 76.75 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 123.855 0.862 . . . . 0.0 111.469 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.804 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 91.4 Cg_endo -79.66 -165.82 0.37 Allowed 'Trans proline' 0 C--N 1.373 1.835 0 C-N-CA 123.355 2.703 . . . . 0.0 112.88 -178.432 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 16.67 0.42 Allowed 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 124.104 0.962 . . . . 0.0 113.14 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.411 ' HG3' ' H ' ' A' ' 80' ' ' ALA . 6.3 pt-20 -147.17 -63.56 0.28 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.846 0.858 . . . . 0.0 109.554 -177.77 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.472 ' HB2' ' HD2' ' A' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.48 1.042 0 C-N-CA 124.091 0.956 . . . . 0.0 112.225 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.622 ' HA ' ' HB2' ' A' ' 28' ' ' ASP . 80.3 mtp . . . . . 0 N--CA 1.479 0.989 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 . . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 m -116.02 125.91 53.09 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.219 1.008 . . . . 0.0 108.791 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.478 ' HB3' HD13 ' A' ' 25' ' ' LEU . . . -99.96 129.02 45.99 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.607 0.763 . . . . 0.0 109.973 -177.851 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.475 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -114.6 119.87 38.25 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.988 0.915 . . . . 0.0 108.587 179.103 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.478 HG13 HD11 ' A' ' 25' ' ' LEU . 3.6 mp -106.81 122.69 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -176.274 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -150.14 161.89 41.51 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.4 0.619 . . . . 0.0 111.73 -172.233 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.643 ' HE ' ' HB2' ' A' ' 21' ' ' ASN . 26.0 mtp180 -119.51 103.54 46.49 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.482 168.942 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.489 ' HG2' ' HA ' ' A' ' 11' ' ' THR . 61.5 Cg_endo -75.59 139.18 22.53 Favored 'Trans proline' 0 CA--C 1.55 1.281 0 C-N-CA 122.265 1.977 . . . . 0.0 112.015 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.65 -11.02 60.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.939 0.895 . . . . 0.0 111.196 173.614 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -128.34 94.01 3.79 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 164.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.489 ' HA ' ' HG2' ' A' ' 8' ' ' PRO . 59.4 m -83.93 138.42 33.16 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.425 -177.352 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.14 119.88 8.16 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 171.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 62.0 mtt -71.4 90.78 0.98 Allowed 'General case' 0 C--O 1.24 0.594 0 O-C-N 124.176 0.922 . . . . 0.0 110.85 -171.376 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -74.32 -36.44 63.7 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.761 -1.109 . . . . 0.0 108.728 169.879 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.2 p -156.43 151.6 26.43 Favored 'General case' 0 C--O 1.244 0.794 0 C-N-CA 124.696 1.199 . . . . 0.0 108.321 170.204 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -77.56 71.47 2.31 Favored Glycine 0 C--N 1.343 0.956 0 N-CA-C 112.286 -0.326 . . . . 0.0 112.286 -178.479 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.6 t -154.85 19.22 0.45 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.078 0.951 . . . . 0.0 110.316 -177.18 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.75 70.91 8.74 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 121.08 0.467 . . . . 0.0 111.548 -173.702 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -91.63 -65.63 0.99 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 168.227 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.7 p -79.7 94.26 5.69 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 164.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.643 ' HB2' ' HE ' ' A' ' 7' ' ' ARG . 11.3 m120 -66.83 141.91 57.52 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.028 -170.798 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.7 p -73.81 149.92 7.79 Favored 'Isoleucine or valine' 0 C--O 1.244 0.8 0 C-N-CA 123.337 0.655 . . . . 0.0 109.768 177.266 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -85.04 127.3 34.16 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -101.43 136.94 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.535 HD21 HD11 ' A' ' 53' ' ' LEU . 58.8 tp -118.26 104.12 10.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.986 1.315 . . . . 0.0 108.715 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.548 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 43.4 mt-10 -104.68 136.92 43.31 Favored 'General case' 0 C--O 1.212 -0.921 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.218 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -143.77 149.86 37.72 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 118.499 0.591 . . . . 0.0 109.918 174.473 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.622 ' HB2' ' HA ' ' A' ' 1' ' ' MET . 8.3 m-20 -61.76 94.15 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.863 0.865 . . . . 0.0 110.272 177.77 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -88.7 137.63 32.15 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.144 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -83.24 9.78 9.93 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.495 0.718 . . . . 0.0 111.315 -176.527 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.7 p -89.17 117.01 67.83 Favored Pre-proline 0 CA--C 1.562 1.433 0 C-N-CA 123.673 0.789 . . . . 0.0 110.621 179.149 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_endo -85.26 -149.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.377 2.058 0 C-N-CA 123.263 2.642 . . . . 0.0 112.374 176.516 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -15.76 2.13 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.694 0.798 . . . . 0.0 112.493 170.55 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -78.82 61.18 3.01 Favored 'General case' 0 CA--C 1.559 1.305 0 C-N-CA 124.041 0.936 . . . . 0.0 109.097 170.774 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.4 pp -88.87 -165.59 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 124.643 1.177 . . . . 0.0 111.159 -179.442 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -56.33 115.78 10.88 Favored Pre-proline 0 CA--C 1.553 1.058 0 C-N-CA 123.272 0.629 . . . . 0.0 110.776 173.218 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -72.5 -7.47 20.93 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.658 2.239 . . . . 0.0 112.193 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.6 mm -59.82 -54.67 31.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 124.837 1.255 . . . . 0.0 111.029 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.0 ptp -106.71 -58.72 1.89 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.151 0.58 . . . . 0.0 110.302 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.27 114.76 0.04 OUTLIER Glycine 0 C--N 1.356 1.647 0 CA-C-O 119.961 -0.355 . . . . 0.0 113.508 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -137.28 29.23 2.74 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 117.548 0.674 . . . . 0.0 111.31 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 73.6 p -62.8 145.19 55.52 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.394 0.678 . . . . 0.0 112.127 -175.903 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 56.0 p -73.26 -53.49 10.74 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 174.874 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.4 t -173.71 -82.69 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.002 0.921 . . . . 0.0 109.254 175.665 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.3 t -116.17 38.4 3.39 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.282 1.033 . . . . 0.0 109.625 -174.158 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -71.12 145.18 49.96 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.699 0.799 . . . . 0.0 111.796 -176.46 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.475 ' HE2' ' HA ' ' A' ' 47' ' ' MET . 24.7 mmt -99.29 -173.48 2.5 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.305 1.042 . . . . 0.0 111.713 -171.587 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.35 90.61 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.583 1.153 . . . . 0.0 112.708 -174.696 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -75.49 151.98 37.93 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.022 -175.818 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -82.29 116.62 21.88 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 169.188 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.9 m -87.68 165.02 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.431 -0.793 . . . . 0.0 109.779 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.548 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -135.94 140.27 43.89 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.563 0.696 . . . . 0.0 112.034 -174.151 . . . . . . . . 3 3 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.535 HD11 HD21 ' A' ' 25' ' ' LEU . 50.6 mt -116.81 156.01 27.98 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.609 1.564 . . . . 0.0 107.403 177.207 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 18.7 p -119.9 133.57 55.53 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.655 -0.653 . . . . 0.0 110.623 174.657 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.414 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 96.0 m-85 -135.54 147.67 48.85 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.886 1.275 . . . . 0.0 109.277 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -67.6 -24.62 65.51 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 123.601 0.563 . . . . 0.0 111.755 -174.409 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 76.1 p -134.44 163.13 30.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.398 0.679 . . . . 0.0 110.2 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -61.63 -39.5 91.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.471 0.708 . . . . 0.0 110.392 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -52.14 -44.62 64.65 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.747 1.279 . . . . 0.0 112.559 -176.263 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.414 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 48.3 mt-30 -70.97 -30.39 66.65 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.543 0.737 . . . . 0.0 111.976 -177.143 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.87 -38.61 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.306 0.643 . . . . 0.0 111.301 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -76.09 -39.02 56.27 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.82 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -30.68 71.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 111.695 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -64.42 -53.42 48.62 Favored 'General case' 0 C--N 1.354 0.803 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 174.899 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.43 -43.93 75.81 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.214 1.005 . . . . 0.0 111.724 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -64.56 -44.57 90.33 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.35 1.06 . . . . 0.0 111.663 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -64.39 -28.78 69.92 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.757 0.823 . . . . 0.0 110.659 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -89.18 -16.84 30.4 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.451 0.7 . . . . 0.0 111.072 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.23 -7.49 81.44 Favored Glycine 0 C--N 1.35 1.335 0 C-N-CA 123.261 0.458 . . . . 0.0 112.89 -176.523 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.2 mt -59.35 112.01 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 123.233 0.613 . . . . 0.0 110.458 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -55.13 135.83 48.9 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.646 173.437 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -141.22 144.9 34.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.492 1.042 . . . . 0.0 112.505 -170.348 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.475 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 18.7 tpp180 -116.92 138.11 51.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.52 1.528 . . . . 0.0 108.298 170.515 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.45 HG11 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -105.06 133.34 49.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-O 121.113 0.482 . . . . 0.0 110.328 174.997 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.3 mp -104.12 112.26 36.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.1 mt -71.14 147.39 93.46 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.747 0.819 . . . . 0.0 111.328 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.406 ' HD2' ' HB2' ' A' ' 80' ' ' ALA . 98.5 Cg_endo -76.9 177.05 9.36 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.414 2.076 . . . . 0.0 111.889 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -27.75 69.31 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.621 0.768 . . . . 0.0 111.655 -179.393 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -97.6 13.95 28.33 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.644 1.177 . . . . 0.0 112.203 -174.118 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.406 ' HB2' ' HD2' ' A' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.478 0.974 0 C-N-CA 122.767 0.427 . . . . 0.0 111.384 176.653 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.51 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 p -135.38 102.53 5.18 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.2 138.61 38.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -167.058 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -107.23 122.04 45.74 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 175.082 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.503 HG13 HD21 ' A' ' 25' ' ' LEU . 4.3 mp -103.44 122.95 56.64 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.178 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -150.15 178.15 9.25 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.634 ' HB3' ' HG3' ' A' ' 77' ' ' PRO . 15.6 ttt180 -136.89 97.14 11.27 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -61.9 116.99 3.81 Favored 'Trans proline' 0 C--N 1.366 1.492 0 C-N-CA 122.913 2.409 . . . . 0.0 113.211 -165.554 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.21 -15.5 60.54 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.377 0.671 . . . . 0.0 110.649 171.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -70.6 -29.21 65.55 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.409 1.083 . . . . 0.0 111.117 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 73.7 p -78.52 137.3 37.85 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 172.994 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.64 -155.21 0.29 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.868 0.867 . . . . 0.0 110.129 175.905 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -54.79 -23.65 19.04 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.213 1.005 . . . . 0.0 112.933 177.315 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -72.08 89.0 1.12 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.704 0.802 . . . . 0.0 109.894 177.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.3 t -126.92 -4.26 6.37 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.261 1.024 . . . . 0.0 110.715 -177.457 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.2 35.62 60.51 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.893 -178.609 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.6 t -163.68 -162.27 0.71 Allowed 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 124.76 1.224 . . . . 0.0 108.534 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.57 170.54 3.93 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 118.231 0.469 . . . . 0.0 109.876 168.568 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -69.25 83.19 0.36 Allowed 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.665 0.745 . . . . 0.0 110.766 -174.318 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 t -164.78 136.93 4.48 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 114.605 -1.18 . . . . 0.0 108.565 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -68.31 132.05 46.42 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.177 0.591 . . . . 0.0 109.912 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.443 HG23 ' HB ' ' A' ' 54' ' ' THR . 14.1 p -82.54 156.91 3.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 176.491 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.416 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 67.8 m95 -88.72 131.86 34.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.099 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.5 t -101.14 139.88 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.244 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.503 HD21 HG13 ' A' ' 5' ' ' ILE . 3.2 tm? -114.64 104.35 11.9 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 105.828 -1.915 . . . . 0.0 105.828 174.563 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -113.35 131.73 55.85 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -143.04 154.98 44.53 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.597 0.759 . . . . 0.0 110.715 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -69.9 115.24 8.9 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 170.05 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.499 ' HB3' HG23 ' A' ' 51' ' ' VAL . . . -70.86 140.66 51.18 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.847 0.859 . . . . 0.0 111.382 -177.577 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.457 ' HB3' ' HE2' ' A' ' 1' ' ' MET . 13.5 pt-20 -72.0 0.07 10.32 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.667 0.787 . . . . 0.0 112.807 -175.582 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -70.57 128.32 91.18 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 123.682 0.793 . . . . 0.0 109.661 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -64.42 -163.17 0.05 OUTLIER 'Trans proline' 0 CA--C 1.551 1.366 0 C-N-CA 123.037 2.492 . . . . 0.0 113.16 170.108 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.591 ' HB3' ' HA ' ' A' ' 46' ' ' ASP . 6.0 ppt_? -65.07 -10.35 29.56 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 114.915 -1.038 . . . . 0.0 112.519 169.281 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -62.17 97.85 0.1 Allowed 'General case' 0 C--N 1.354 0.799 0 C-N-CA 124.4 1.08 . . . . 0.0 111.038 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.674 HG23 ' HA ' ' A' ' 41' ' ' TYR . 36.6 pt -84.58 166.99 1.97 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.922 176.951 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -83.02 126.14 73.22 Favored Pre-proline 0 CA--C 1.546 0.796 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 165.136 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -66.31 -2.66 7.46 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.574 2.182 . . . . 0.0 114.243 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.7 mm -59.99 -48.92 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 123.126 0.57 . . . . 0.0 109.712 165.135 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.4 ptm -107.49 179.8 4.14 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.481 -174.604 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -84.78 -172.57 49.24 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-N 115.73 -0.668 . . . . 0.0 113.468 -179.327 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.674 ' HA ' HG23 ' A' ' 35' ' ' ILE . 66.8 t80 -98.4 -33.55 11.0 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.025 0.93 . . . . 0.0 112.65 -173.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.9 t -63.14 -14.97 55.0 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -166.447 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.8 m -73.73 -24.42 59.9 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.135 0.574 . . . . 0.0 112.515 177.236 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.5 p -139.73 114.77 9.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.852 0.861 . . . . 0.0 109.794 178.502 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.1 t -81.65 -173.7 4.57 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.754 0.822 . . . . 0.0 110.7 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.591 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . 3.1 m-20 -57.02 -24.07 51.01 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.573 1.149 . . . . 0.0 113.412 -176.125 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -74.68 -77.41 0.12 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.407 0.283 . . . . 0.0 110.281 176.305 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 ptmt -179.8 -166.37 0.08 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.354 1.062 . . . . 0.0 109.304 -169.211 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -136.17 -173.98 3.55 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.671 0.789 . . . . 0.0 108.875 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -106.15 162.31 13.75 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.301 0.64 . . . . 0.0 110.246 176.054 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.499 HG23 ' HB3' ' A' ' 29' ' ' ALA . 46.3 t -137.71 147.0 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 124.975 1.31 . . . . 0.0 107.862 172.809 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.416 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 14.7 ptpt -144.0 139.01 28.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.588 0.708 . . . . 0.0 111.796 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.5 mt -118.47 157.79 26.58 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.469 1.507 . . . . 0.0 108.026 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.443 ' HB ' HG23 ' A' ' 22' ' ' VAL . 34.7 p -119.01 135.09 54.8 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.177 0.591 . . . . 0.0 109.956 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.522 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.9 m-85 -138.38 148.45 44.52 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.206 1.402 . . . . 0.0 109.787 -178.342 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -63.14 -32.98 74.49 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.353 0.661 . . . . 0.0 111.896 -174.631 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.9 p -134.65 164.12 28.22 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.658 0.783 . . . . 0.0 111.274 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.2 -46.1 86.42 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.137 173.96 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -48.42 -43.81 34.58 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 124.999 1.437 . . . . 0.0 112.811 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.522 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 78.2 mt-30 -70.12 -35.15 73.9 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.529 0.731 . . . . 0.0 111.774 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.435 ' HB2' ' HB2' ' A' ' 25' ' ' LEU . . . -76.84 -39.12 52.3 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.491 0.662 . . . . 0.0 110.653 -175.571 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -30.22 55.43 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.09 -36.0 76.42 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.296 0.639 . . . . 0.0 111.757 173.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -62.2 -58.44 7.76 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.58 -48.09 63.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.948 1.299 . . . . 0.0 112.423 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -61.06 -46.1 92.05 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.318 1.047 . . . . 0.0 111.392 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -59.56 -34.85 73.21 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.536 1.135 . . . . 0.0 111.242 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -87.66 -20.49 26.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.84 0.856 . . . . 0.0 111.587 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.57 -1.93 69.7 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 123.172 0.295 . . . . 0.0 113.143 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.8 mt -59.07 112.24 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.525 0.73 . . . . 0.0 110.939 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -58.0 138.1 56.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.281 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -146.71 148.84 32.41 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 118.719 0.69 . . . . 0.0 112.658 -172.964 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -114.18 122.96 48.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.007 1.323 . . . . 0.0 108.978 170.182 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.41 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -91.48 137.06 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.178 0.591 . . . . 0.0 110.007 173.283 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -122.15 137.18 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.776 1.63 . . . . 0.0 107.817 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.8 mt -95.25 137.69 22.08 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 122.756 0.423 . . . . 0.0 110.242 175.871 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.634 ' HG3' ' HB3' ' A' ' 7' ' ' ARG . 44.4 Cg_endo -85.38 -177.92 2.87 Favored 'Trans proline' 0 C--N 1.367 1.506 0 C-N-CA 123.652 2.901 . . . . 0.0 112.371 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.424 ' HD3' ' N ' ' A' ' 79' ' ' GLU . 0.1 OUTLIER -69.38 -33.52 73.17 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -176.118 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.424 ' N ' ' HD3' ' A' ' 78' ' ' LYS . 0.3 OUTLIER -96.91 -53.09 3.64 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.792 0.437 . . . . 0.0 110.995 -178.326 . . . . . . . . 3 3 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 C-N-CA 124.309 1.043 . . . . 0.0 112.612 -174.818 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.424 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.115 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 . . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.0 p -123.75 128.1 49.09 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.006 0.922 . . . . 0.0 110.129 -175.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.421 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -99.99 146.25 26.93 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -110.09 124.93 52.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.559 HG12 HD22 ' A' ' 25' ' ' LEU . 71.9 mt -98.41 129.76 48.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.686 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 173.235 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -152.15 -179.71 7.76 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.824 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.806 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 46.7 ttt180 -144.28 95.59 5.5 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 176.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -78.29 -170.22 0.93 Allowed 'Trans proline' 0 C--N 1.366 1.477 0 C-N-CA 123.082 2.521 . . . . 0.0 112.842 -163.735 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.4 ' HA ' ' HE2' ' A' ' 78' ' ' LYS . . . -78.29 -21.26 49.99 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.014 0.526 . . . . 0.0 110.998 173.846 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -148.42 124.01 10.43 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.113 0.965 . . . . 0.0 109.642 -175.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.1 p -96.24 -51.0 4.57 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.558 0.743 . . . . 0.0 111.252 -175.977 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.26 102.6 3.75 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.187 0.595 . . . . 0.0 110.274 -178.718 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.5 ptt? -94.99 -32.74 13.02 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.78 0.832 . . . . 0.0 112.227 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.99 132.98 47.5 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -172.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.3 t 66.56 -80.53 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.196 1.399 . . . . 0.0 111.493 175.555 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -81.55 77.32 2.06 Favored Glycine 0 C--N 1.348 1.247 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 177.032 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 43.2 p -73.52 85.72 1.55 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.829 0.852 . . . . 0.0 110.953 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.87 128.52 34.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.0 -177.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -82.44 -28.1 31.52 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.454 0.701 . . . . 0.0 110.537 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.3 p -77.27 95.54 4.37 Favored 'General case' 0 C--O 1.244 0.776 0 C-N-CA 123.6 0.76 . . . . 0.0 109.534 176.134 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -76.55 91.59 3.39 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 172.855 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 31.5 m -98.5 -169.15 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 C-N-CA 124.986 1.315 . . . . 0.0 110.537 -177.576 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -86.62 136.7 32.95 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.448 0.699 . . . . 0.0 109.153 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.7 t -101.61 139.42 22.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.912 173.185 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.559 HD22 HG12 ' A' ' 5' ' ' ILE . 2.8 tm? -117.81 104.55 11.07 Favored 'General case' 0 C--N 1.343 0.326 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -107.47 134.32 50.68 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.628 -1.169 . . . . 0.0 107.886 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -141.52 149.97 41.56 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.651 0.78 . . . . 0.0 109.555 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -67.16 106.36 1.98 Allowed 'General case' 0 C--O 1.247 0.936 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.476 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -61.67 118.11 6.68 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 124.012 0.82 . . . . 0.0 109.55 178.939 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -84.52 39.06 0.71 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.174 0.989 . . . . 0.0 111.425 -176.776 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.5 p -53.63 131.45 55.36 Favored Pre-proline 0 CA--C 1.556 1.184 0 C-N-CA 124.174 0.99 . . . . 0.0 109.763 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.6 -164.04 0.09 OUTLIER 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 122.563 2.175 . . . . 0.0 113.084 -174.704 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -63.54 -27.26 69.14 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.322 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -82.1 88.17 6.45 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 170.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 37.9 mm -69.45 139.5 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 175.927 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -45.88 134.72 6.62 Favored Pre-proline 0 N--CA 1.491 1.599 0 C-N-CA 124.713 1.205 . . . . 0.0 111.779 -173.875 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -46.37 -47.14 15.74 Favored 'Trans proline' 0 C--N 1.386 2.509 0 C-N-CA 123.93 3.087 . . . . 0.0 113.375 -173.673 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.4 mt -47.92 -43.96 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.898 1.279 . . . . 0.0 112.223 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.9 ptm -118.57 21.99 12.28 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.759 0.823 . . . . 0.0 111.0 -175.48 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -160.4 51.36 0.36 Allowed Glycine 0 C--N 1.344 1.013 0 CA-C-N 116.699 -0.228 . . . . 0.0 113.126 -175.453 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -72.2 -37.74 69.19 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.979 0.512 . . . . 0.0 110.213 172.229 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.3 p -79.58 162.47 25.31 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.805 0.842 . . . . 0.0 111.604 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.5 m -71.81 -53.75 12.34 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.481 0.712 . . . . 0.0 109.458 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 24.1 m -80.3 77.95 7.02 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 170.23 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 22.7 p -92.43 -179.98 5.36 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.123 -175.24 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.91 160.72 31.32 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.527 0.731 . . . . 0.0 111.064 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.3 ptt? -71.61 -171.78 0.7 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.778 0.831 . . . . 0.0 111.417 -177.093 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.496 ' N ' ' HD2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -82.61 91.17 6.9 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 174.226 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -68.54 166.09 17.76 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.048 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.1 pp0? -87.69 132.12 34.23 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 166.671 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 33.3 m -111.36 166.64 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 123.702 0.801 . . . . 0.0 109.093 169.436 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.6 pttt -144.87 155.88 43.7 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 121.597 0.713 . . . . 0.0 112.73 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.436 HD13 HD13 ' A' ' 25' ' ' LEU . 43.0 mt -125.39 160.4 29.48 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.74 1.616 . . . . 0.0 108.342 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 15.5 p -118.84 129.41 55.2 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.552 0.741 . . . . 0.0 109.795 172.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.15 147.31 50.55 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.79 1.636 . . . . 0.0 108.169 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -67.28 -31.36 71.62 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.615 0.766 . . . . 0.0 111.227 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 55.2 p -132.41 160.45 36.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.077 0.951 . . . . 0.0 110.112 -177.464 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -60.45 -40.87 92.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.375 0.67 . . . . 0.0 110.481 171.544 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -47.33 -47.21 25.82 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 124.497 1.123 . . . . 0.0 112.717 177.929 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -69.65 -31.03 68.87 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 122.967 0.507 . . . . 0.0 111.761 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.34 -42.99 34.53 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.561 0.744 . . . . 0.0 111.599 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -69.86 -42.68 73.18 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.894 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.65 -32.62 71.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.23 0.612 . . . . 0.0 111.474 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -64.68 -60.01 3.6 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 123.228 0.611 . . . . 0.0 109.533 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.94 -50.22 69.4 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.68 1.192 . . . . 0.0 112.332 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -59.57 -42.24 92.01 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.976 0.91 . . . . 0.0 111.566 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -62.22 -30.57 71.18 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.646 1.178 . . . . 0.0 110.931 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -87.88 -19.53 27.24 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.274 0.63 . . . . 0.0 111.058 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.04 -2.89 66.47 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 112.845 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 45.6 mt -67.14 108.56 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.172 0 CA-C-O 121.274 0.559 . . . . 0.0 110.537 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.44 140.77 57.08 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.845 171.524 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.421 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 34.5 p90 -142.31 151.63 42.16 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 118.633 0.651 . . . . 0.0 112.032 -169.394 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -120.42 115.49 23.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.247 1.019 . . . . 0.0 108.441 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -81.83 133.45 29.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.069 0.547 . . . . 0.0 111.1 177.723 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.02 136.9 51.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 125.721 1.608 . . . . 0.0 107.477 174.136 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.5 mt -71.34 147.62 93.05 Favored Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 123.214 0.606 . . . . 0.0 110.875 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.806 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 57.8 Cg_endo -73.29 175.07 11.07 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 122.969 2.446 . . . . 0.0 113.795 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.4 ' HE2' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -74.32 -22.32 59.31 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.153 172.439 . . . . . . . . 3 3 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.528 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 7.0 pt-20 -96.55 5.51 50.63 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.282 1.033 . . . . 0.0 111.551 -175.565 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.855 0 C-N-CA 123.078 0.551 . . . . 0.0 111.064 178.942 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.415 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.8 mpt? . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 . . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' SER . . . . . 0.422 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 14.6 t -121.12 128.66 52.77 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.761 0.425 . . . . 0.0 111.257 -176.512 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.404 ' HB1' HD13 ' A' ' 25' ' ' LEU . . . -100.21 137.33 38.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.256 1.022 . . . . 0.0 110.394 179.972 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.433 ' HZ2' ' HB3' ' A' ' 4' ' ' LYS . 0.2 OUTLIER -108.55 119.98 41.09 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 108.042 175.113 . . . . . . . . 3 3 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.0 mp -105.56 123.5 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 175.553 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.9 p90 -156.07 172.7 17.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.652 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.658 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 49.9 ttt180 -136.19 96.97 12.33 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.088 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.522 ' HG2' HG23 ' A' ' 11' ' ' THR . 78.3 Cg_endo -78.5 153.54 27.09 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 122.186 1.924 . . . . 0.0 112.217 -173.047 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.17 -12.98 61.48 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.963 0.905 . . . . 0.0 111.377 173.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -117.91 110.63 17.97 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.067 0.947 . . . . 0.0 110.62 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.522 HG23 ' HG2' ' A' ' 8' ' ' PRO . 16.6 p -146.19 -39.26 0.22 Allowed 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.04 1.336 . . . . 0.0 108.198 168.505 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 61.96 47.32 5.97 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.568 1.147 . . . . 0.0 111.396 172.983 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 81.2 mmm -84.19 136.5 33.94 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.144 -0.935 . . . . 0.0 108.703 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -129.18 92.43 3.38 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.34 0.656 . . . . 0.0 110.203 -176.913 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' SER . . . . . 0.4 ' OG ' HG23 ' A' ' 17' ' ' THR . 35.6 t -170.04 167.45 8.89 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.782 0.833 . . . . 0.0 109.655 172.274 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -75.38 -27.55 63.45 Favored Glycine 0 C--N 1.345 1.029 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 172.924 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.4 HG23 ' OG ' ' A' ' 15' ' ' SER . 12.4 t -83.35 -19.31 36.39 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.588 0.755 . . . . 0.0 110.94 176.435 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.55 111.06 19.39 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.571 0.748 . . . . 0.0 110.601 -173.315 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -62.21 143.31 56.98 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.596 0.759 . . . . 0.0 110.126 172.019 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.1 p -52.02 -35.94 48.57 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.118 0.967 . . . . 0.0 111.888 -176.793 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.482 ' HA ' ' OG1' ' A' ' 11' ' ' THR . 12.7 m120 -120.56 126.54 50.58 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 124.806 1.242 . . . . 0.0 107.88 167.253 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 p -120.51 155.56 23.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 124.572 1.149 . . . . 0.0 108.865 -178.209 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -75.07 123.06 24.52 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 67.8 t -101.48 138.37 25.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.509 ' HB2' ' HB3' ' A' ' 61' ' ' ALA . 52.4 tp -116.06 105.31 12.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 173.572 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.521 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 16.1 mt-10 -106.58 137.85 43.84 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 172.12 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -143.95 154.0 42.85 Favored 'General case' 0 CA--C 1.502 -0.875 0 CA-C-N 117.571 0.169 . . . . 0.0 110.779 177.736 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.8 102.86 0.5 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 164.792 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.3 123.41 13.72 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 123.855 0.722 . . . . 0.0 110.438 -175.473 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.8 3.08 3.48 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.039 0.936 . . . . 0.0 112.568 -175.654 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -88.32 132.26 39.86 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 124.155 0.982 . . . . 0.0 109.401 -179.684 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.43 -159.32 0.1 Allowed 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.907 2.405 . . . . 0.0 111.836 174.4 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -68.83 -14.71 63.2 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.703 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -75.36 87.23 2.55 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 123.331 0.653 . . . . 0.0 109.661 174.403 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.536 HD11 ' HA3' ' A' ' 40' ' ' GLY . 2.1 pp -124.54 -162.21 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 125.019 1.328 . . . . 0.0 108.928 176.358 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -62.28 117.6 31.85 Favored Pre-proline 0 N--CA 1.484 1.237 0 CA-C-N 118.285 0.493 . . . . 0.0 110.573 173.427 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.64 -5.36 12.87 Favored 'Trans proline' 0 C--N 1.383 2.342 0 C-N-CA 122.947 2.431 . . . . 0.0 113.342 -174.579 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.3 mt -59.77 -50.12 81.25 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 123.917 0.887 . . . . 0.0 110.111 168.562 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -105.2 8.67 34.11 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.006 0.922 . . . . 0.0 111.927 -172.78 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.536 ' HA3' HD11 ' A' ' 35' ' ' ILE . . . -173.58 -152.89 9.2 Favored Glycine 0 C--N 1.344 1.02 0 CA-C-O 119.832 -0.427 . . . . 0.0 113.004 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 23.3 t80 59.27 45.28 14.36 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.511 1.124 . . . . 0.0 110.168 -176.499 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 11.9 t -165.19 -150.43 0.13 Allowed 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 114.35 -1.295 . . . . 0.0 107.91 -175.69 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.0 t -54.5 -41.76 69.97 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 118.772 0.714 . . . . 0.0 110.52 171.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 35.6 t -70.45 107.07 3.66 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 167.257 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.6 t -148.77 89.69 1.71 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.461 0.704 . . . . 0.0 109.157 -174.884 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -80.11 140.47 36.41 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.186 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -65.06 -63.28 1.15 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 -178.73 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -175.11 128.67 0.29 Allowed 'General case' 0 C--O 1.241 0.611 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 176.192 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -89.48 -171.62 3.29 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -127.87 96.68 4.57 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.842 0.857 . . . . 0.0 108.906 174.295 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m -81.47 166.08 2.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 C-N-CA 123.659 0.784 . . . . 0.0 110.755 176.844 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.521 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 3.6 ptpp? -133.21 135.77 45.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.792 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.505 HD12 HD23 ' A' ' 25' ' ' LEU . 42.4 mt -117.47 142.91 46.59 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -114.68 128.95 56.59 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -134.56 156.64 48.31 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.254 1.022 . . . . 0.0 110.133 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -65.14 -31.3 72.42 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.001 0.813 . . . . 0.0 111.466 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 49.6 p -135.62 164.06 28.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.412 0.685 . . . . 0.0 110.965 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.89 -41.73 87.85 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.75 169.017 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -49.83 -45.74 50.54 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.922 1.389 . . . . 0.0 111.474 -174.343 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -72.19 -30.03 64.56 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.046 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.509 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . . . -79.48 -40.59 29.4 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.227 0.611 . . . . 0.0 111.067 -176.912 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -70.78 -39.58 73.1 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.936 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.22 -36.77 66.32 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.739 0.816 . . . . 0.0 112.5 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -66.59 -55.91 13.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.019 0.528 . . . . 0.0 110.299 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.79 -47.09 64.36 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.437 1.095 . . . . 0.0 112.056 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -59.45 -45.24 92.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.091 0.956 . . . . 0.0 111.647 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.5 ttt180 -54.09 -39.39 66.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.737 1.215 . . . . 0.0 111.309 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.98 -27.0 36.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.434 0.694 . . . . 0.0 111.432 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 98.3 1.51 58.03 Favored Glycine 0 C--N 1.349 1.263 0 O-C-N 123.216 0.323 . . . . 0.0 112.592 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.9 mt -69.35 107.25 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 CA-C-O 121.403 0.621 . . . . 0.0 110.201 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.4 pt-20 -54.04 143.94 20.72 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.018 170.826 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -147.36 149.25 32.43 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.501 1.046 . . . . 0.0 113.026 -168.538 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -110.76 125.94 54.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.484 1.114 . . . . 0.0 109.928 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 92.4 t -89.89 118.59 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 173.777 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 77.1 mt -122.6 117.34 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.03 1.332 . . . . 0.0 108.444 -174.45 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 80.2 mt -71.0 147.53 93.93 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.045 0.938 . . . . 0.0 112.239 -174.273 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.658 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 86.5 Cg_endo -79.4 -179.33 5.3 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 123.375 2.717 . . . . 0.0 113.245 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -31.2 72.3 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.948 173.286 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -86.96 9.95 17.84 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.493 1.117 . . . . 0.0 111.696 -176.362 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.066 0 C-N-CA 122.82 0.448 . . . . 0.0 110.831 175.344 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.444 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.3 mpt? . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.8 m -133.08 165.08 25.59 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -168.908 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.5 155.38 24.24 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 113.132 0.789 . . . . 0.0 113.132 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -113.05 123.73 50.97 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.062 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.418 HG12 ' HG ' ' A' ' 25' ' ' LEU . 89.9 mt -105.22 127.36 59.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 174.926 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -148.69 176.5 10.31 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 123.369 0.668 . . . . 0.0 109.434 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.502 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 34.1 ttt180 -140.72 95.72 7.77 Favored Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 173.806 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -82.05 179.52 5.51 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 122.968 2.446 . . . . 0.0 114.607 -163.924 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.409 ' HA ' ' HD3' ' A' ' 78' ' ' LYS . . . -86.93 -20.97 26.57 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.33 171.526 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.408 ' HZ1' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -159.91 155.66 25.97 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.143 0.977 . . . . 0.0 109.564 174.329 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.0 t -168.62 -160.85 0.31 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -177.103 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.49 103.07 0.08 Allowed 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 169.778 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.436 ' HA ' ' OG1' ' A' ' 17' ' ' THR . 67.2 mtm -68.62 93.32 0.51 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.316 0.646 . . . . 0.0 110.674 -173.531 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -115.95 -63.04 1.51 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.992 0.917 . . . . 0.0 110.077 -174.565 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.6 p -137.46 97.23 3.41 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.922 0.889 . . . . 0.0 109.328 -175.237 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 73.14 -86.28 0.58 Allowed Glycine 0 C--N 1.344 1.005 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -171.09 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.436 ' OG1' ' HA ' ' A' ' 13' ' ' MET . 30.0 p 51.34 27.67 3.81 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 125.487 1.515 . . . . 0.0 114.381 167.261 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -151.4 -82.63 0.09 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.19 0.596 . . . . 0.0 110.389 177.499 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -72.06 -60.66 2.12 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.836 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.8 t -91.06 143.76 26.36 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 162.603 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -147.32 161.44 40.98 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -176.163 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.5 m -110.99 176.48 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.989 0.916 . . . . 0.0 108.764 171.293 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.4 m95 -86.64 125.93 34.17 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.3 t -100.52 136.23 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.418 ' HG ' HG12 ' A' ' 5' ' ' ILE . 5.5 tt -116.07 108.37 16.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 178.205 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -107.05 135.0 49.35 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 175.56 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.0 p90 -145.95 153.04 40.36 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -175.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -61.45 100.83 0.15 Allowed 'General case' 0 C--O 1.242 0.706 0 O-C-N 124.412 1.07 . . . . 0.0 108.483 163.832 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -53.15 140.41 26.02 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.897 1.279 . . . . 0.0 113.721 -168.931 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -85.99 26.67 0.97 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.211 1.004 . . . . 0.0 111.517 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -65.25 122.84 82.08 Favored Pre-proline 0 CA--C 1.557 1.227 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.72 -176.59 3.23 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.75 2.3 . . . . 0.0 113.197 -172.967 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -67.19 -14.66 63.12 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.51 177.933 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -77.29 30.41 0.14 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 124.109 0.964 . . . . 0.0 112.388 177.626 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 26.7 pt -61.76 122.01 11.4 Favored 'Isoleucine or valine' 0 C--N 1.357 0.933 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 169.517 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.456 ' HB3' ' O ' ' A' ' 39' ' ' MET . 16.6 t0 -67.89 127.35 93.34 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.916 -172.713 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . 0.407 ' HA ' ' HB3' ' A' ' 41' ' ' TYR . 19.0 Cg_endo -51.65 -27.11 24.89 Favored 'Trans proline' 0 C--N 1.377 2.036 0 C-N-CA 123.956 3.104 . . . . 0.0 113.055 177.943 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.1 mm -84.38 -53.46 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 123.368 0.667 . . . . 0.0 109.466 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.456 ' O ' ' HB3' ' A' ' 36' ' ' ASP . 65.1 mtt -131.35 103.17 6.3 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.638 0.775 . . . . 0.0 110.223 -176.651 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 135.35 -41.85 1.4 Allowed Glycine 0 N--CA 1.471 0.978 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . 0.407 ' HB3' ' HA ' ' A' ' 37' ' ' PRO . 59.3 t80 -107.87 99.29 8.77 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 175.249 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 73.9 p -132.86 166.96 21.09 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.865 0.866 . . . . 0.0 109.675 176.917 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.5 t -64.67 -55.53 19.54 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.127 0.571 . . . . 0.0 110.179 177.8 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 58.1 m -82.68 84.41 7.31 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 173.025 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 22.3 t -164.15 -177.32 4.92 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 114.581 -1.19 . . . . 0.0 107.849 178.075 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -116.1 -178.14 3.33 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 177.187 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.9 ttt -62.31 -43.64 98.36 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.276 0.63 . . . . 0.0 109.46 166.491 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.406 ' HD3' ' N ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -153.47 142.04 20.83 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.555 1.142 . . . . 0.0 108.948 175.989 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -78.01 179.94 6.48 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.616 0.767 . . . . 0.0 111.647 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -128.59 90.4 3.05 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.081 0.943 . . . . 0.0 108.535 173.788 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.4 p -93.06 165.96 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 C-N-CA 124.307 1.043 . . . . 0.0 110.16 -174.632 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.401 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 5.3 ptpp? -135.4 140.79 45.23 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.316 0.579 . . . . 0.0 111.833 -173.993 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.4 mp -120.47 153.12 37.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.988 1.315 . . . . 0.0 107.887 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.1 p -118.11 133.52 55.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.866 0.466 . . . . 0.0 110.634 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -133.84 147.18 51.17 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.108 1.363 . . . . 0.0 108.512 -177.5 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.411 ' HB2' HE22 ' A' ' 60' ' ' GLN . 30.7 mm-40 -71.07 -24.53 62.34 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -172.764 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 81.1 p -136.78 163.2 31.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.647 0.779 . . . . 0.0 109.736 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -64.51 -36.28 83.7 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.757 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -51.0 -48.93 61.25 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.912 0.885 . . . . 0.0 111.613 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.411 HE22 ' HB2' ' A' ' 56' ' ' GLU . 48.7 mt-30 -69.29 -29.36 67.22 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.319 -176.785 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.4 -41.51 32.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.17 0.588 . . . . 0.0 110.994 177.424 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.512 ' O ' ' HG3' ' A' ' 66' ' ' GLN . 13.0 pt-20 -77.43 -44.47 28.98 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.426 -169.991 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.14 69.02 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.414 1.086 . . . . 0.0 112.16 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -64.07 -54.7 29.99 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 172.319 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.5 -44.87 81.11 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.473 1.109 . . . . 0.0 111.944 178.774 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . 0.512 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 73.1 mt-30 -60.74 -44.28 96.87 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.105 0.962 . . . . 0.0 110.636 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -62.26 -31.07 71.59 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.005 1.322 . . . . 0.0 111.01 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -87.19 -22.16 25.46 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.051 0.94 . . . . 0.0 110.745 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.29 -1.31 72.96 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.704 -172.382 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.28 109.86 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-O 121.501 0.667 . . . . 0.0 110.357 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.17 133.94 53.87 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 113.793 -1.549 . . . . 0.0 108.102 171.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 55.7 p90 -140.38 152.68 45.95 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.611 -0.681 . . . . 0.0 110.927 -171.333 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 tpt85 -118.16 116.46 26.87 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 171.297 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.9 m -82.28 132.35 31.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-O 121.457 0.646 . . . . 0.0 110.69 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 mp -114.4 136.15 51.91 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.29 152.63 84.38 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 123.339 0.656 . . . . 0.0 111.863 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.502 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 37.2 Cg_endo -66.22 162.58 35.35 Favored 'Trans proline' 0 C--N 1.373 1.83 0 C-N-CA 122.437 2.091 . . . . 0.0 112.388 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.409 ' HD3' ' HA ' ' A' ' 9' ' ' ALA . 2.2 pttm -59.8 -30.58 69.0 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.163 0.585 . . . . 0.0 111.248 -178.804 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -109.96 30.78 6.39 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.12 0.968 . . . . 0.0 110.28 -177.486 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.639 0 C-N-CA 123.327 0.651 . . . . 0.0 111.705 174.875 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.493 ' HG2' HG22 ' A' ' 70' ' ' ILE . 47.7 ttp . . . . . 0 N--CA 1.477 0.883 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -121.93 126.92 49.73 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.136 0.974 . . . . 0.0 109.299 -177.329 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.449 ' HB2' HD12 ' A' ' 25' ' ' LEU . . . -100.93 136.95 39.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.946 0.898 . . . . 0.0 109.738 -177.461 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -115.28 125.29 53.12 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 mp -105.37 121.82 57.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -147.62 172.3 14.25 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.393 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.667 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 38.7 ttt-85 -139.4 94.29 9.6 Favored Pre-proline 0 C--O 1.24 0.567 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 177.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.596 ' HB2' ' HG2' ' A' ' 10' ' ' LYS . 68.9 Cg_endo -86.67 154.22 8.88 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.866 2.378 . . . . 0.0 113.537 -168.987 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . 0.64 ' HB1' ' HG2' ' A' ' 78' ' ' LYS . . . -86.16 -13.57 46.64 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.161 0.984 . . . . 0.0 111.354 173.266 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . 0.596 ' HG2' ' HB2' ' A' ' 8' ' ' PRO . 16.2 ptpt -77.93 -0.79 28.93 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.716 0.806 . . . . 0.0 111.551 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.547 HG23 ' HG2' ' A' ' 8' ' ' PRO . 18.3 p -54.64 143.66 24.16 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.732 0.813 . . . . 0.0 111.971 175.611 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.79 -172.58 3.92 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.761 0.824 . . . . 0.0 109.931 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.4 mtt 59.53 25.67 14.54 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.008 0.923 . . . . 0.0 111.972 172.727 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . 0.4 ' HG2' ' HB ' ' A' ' 20' ' ' THR . 89.9 mt-30 -75.18 99.63 4.05 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.148 0.579 . . . . 0.0 111.419 -174.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 t -105.75 -171.02 1.83 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.298 1.039 . . . . 0.0 109.089 174.208 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -75.56 74.4 1.52 Allowed Glycine 0 C--N 1.35 1.358 0 C-N-CA 122.65 0.166 . . . . 0.0 113.058 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.426 HG23 HG23 ' A' ' 20' ' ' THR . 7.8 t -162.11 152.77 17.39 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.6 1.16 . . . . 0.0 109.227 177.625 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.11 -17.33 52.87 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.259 0.624 . . . . 0.0 110.793 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -62.29 -23.09 66.52 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.556 1.142 . . . . 0.0 111.931 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.426 HG23 HG23 ' A' ' 17' ' ' THR . 42.7 p -48.11 -40.88 24.86 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 125.318 1.447 . . . . 0.0 113.284 -176.899 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . 0.461 ' ND2' ' HA ' ' A' ' 9' ' ' ALA . 11.0 m120 -85.54 92.47 8.54 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 172.983 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.9 p -88.82 151.51 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.145 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.411 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 77.1 m95 -77.5 116.05 17.76 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 177.178 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.495 HG22 HG22 ' A' ' 54' ' ' THR . 40.5 t -100.48 139.59 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.449 HD12 ' HB2' ' A' ' 3' ' ' ALA . 47.8 tp -116.24 106.08 13.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -114.94 133.14 56.26 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -144.59 154.38 42.78 Favored 'General case' 0 CA--C 1.505 -0.752 0 C-N-CA 123.807 0.843 . . . . 0.0 109.443 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.608 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 7.7 p-10 -84.25 123.46 30.16 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 170.484 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -93.57 114.39 26.72 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -171.383 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.469 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 8.4 pt-20 -75.16 64.3 1.4 Allowed 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 122.223 1.011 . . . . 0.0 110.369 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.9 p -115.4 127.0 27.17 Favored Pre-proline 0 CA--C 1.546 0.818 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -176.355 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.54 175.17 10.53 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.345 2.03 . . . . 0.0 112.064 178.969 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -69.93 -1.31 9.24 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.658 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -60.42 90.87 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.47 1.108 . . . . 0.0 111.179 173.901 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 65.3 mt -78.14 145.78 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 172.054 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -117.29 143.36 31.79 Favored Pre-proline 0 CA--C 1.544 0.733 0 CA-C-O 118.668 -0.682 . . . . 0.0 109.78 -174.154 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -49.76 -23.66 8.76 Favored 'Trans proline' 0 C--N 1.382 2.293 0 C-N-CA 123.864 3.043 . . . . 0.0 114.912 175.029 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.3 mt -75.7 -58.12 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 173.64 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 18.7 ptp -102.8 90.93 3.96 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.561 0.745 . . . . 0.0 109.68 -175.51 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -87.18 40.49 3.08 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 115.654 -0.703 . . . . 0.0 114.263 -173.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -78.7 99.47 6.64 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.968 0.507 . . . . 0.0 110.006 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 78.3 p -81.87 -12.14 58.6 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-O 121.377 0.608 . . . . 0.0 110.309 169.59 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.3 p -72.89 -8.4 55.43 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.564 1.146 . . . . 0.0 111.793 173.168 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 73.9 m -52.94 122.22 8.86 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.87 0.868 . . . . 0.0 110.798 172.477 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.624 ' HB3' ' SD ' ' A' ' 47' ' ' MET . 15.7 m -66.81 154.59 40.45 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.158 0.983 . . . . 0.0 112.288 -171.792 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -65.95 -39.47 90.48 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.455 0.702 . . . . 0.0 110.473 175.788 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' MET . . . . . 0.624 ' SD ' ' HB3' ' A' ' 45' ' ' SER . 1.6 pmm? -83.41 167.44 17.5 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.349 171.062 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.608 ' HG2' ' HB2' ' A' ' 28' ' ' ASP . 0.1 OUTLIER -63.4 99.19 0.19 Allowed 'General case' 0 CA--C 1.566 1.583 0 CA-C-O 121.802 0.81 . . . . 0.0 109.551 178.526 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -58.99 127.32 31.65 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.737 1.215 . . . . 0.0 112.758 -166.574 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.438 ' HA ' ' HA ' ' A' ' 28' ' ' ASP . 4.6 pm0 -85.69 91.64 8.35 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 121.727 0.775 . . . . 0.0 110.078 -177.763 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.9 m -89.61 163.91 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 123.757 0.823 . . . . 0.0 110.079 177.385 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -143.82 142.22 30.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.803 0.811 . . . . 0.0 112.28 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.31 159.96 23.96 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.324 1.85 . . . . 0.0 107.281 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.495 HG22 HG22 ' A' ' 24' ' ' VAL . 25.1 p -125.76 131.38 52.52 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.718 0.407 . . . . 0.0 110.743 177.349 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -129.44 153.61 47.77 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.176 1.391 . . . . 0.0 109.137 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -70.62 -25.56 63.08 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.008 0.523 . . . . 0.0 112.097 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 71.3 p -134.15 162.56 31.79 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.986 0.422 . . . . 0.0 111.033 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -58.48 -44.56 89.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.863 170.293 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -54.22 -43.64 70.98 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.652 1.22 . . . . 0.0 112.207 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.5 mt-30 -71.07 -30.58 66.75 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.083 0.553 . . . . 0.0 111.813 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . 0.42 ' HB3' ' HB2' ' A' ' 25' ' ' LEU . . . -80.41 -38.54 30.04 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.299 0.571 . . . . 0.0 110.859 -177.034 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -76.34 -37.36 57.43 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.099 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.06 73.34 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.77 0.828 . . . . 0.0 111.722 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -65.8 -51.3 60.18 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.239 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.37 74.01 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.383 1.073 . . . . 0.0 111.515 175.302 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -63.65 -42.94 98.06 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.389 1.076 . . . . 0.0 111.63 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -55.77 -36.83 67.77 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.899 1.279 . . . . 0.0 110.735 175.554 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.419 ' HB2' HG13 ' A' ' 70' ' ' ILE . 35.0 mmtp -88.62 -19.21 26.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.458 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.27 -3.33 66.33 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-O 119.967 -0.352 . . . . 0.0 112.992 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.493 HG22 ' HG2' ' A' ' 1' ' ' MET . 22.1 mt -61.61 109.58 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 123.05 0.54 . . . . 0.0 109.569 -178.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.05 139.06 42.55 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 113.544 -1.662 . . . . 0.0 108.79 171.687 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -140.52 147.4 39.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.414 1.006 . . . . 0.0 112.005 -169.346 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -122.34 136.67 54.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.841 1.257 . . . . 0.0 108.439 169.101 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 m -105.69 138.23 31.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.131 0.572 . . . . 0.0 110.246 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.87 136.39 57.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.01 1.724 . . . . 0.0 107.029 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 85.6 mt -73.66 153.98 89.46 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 123.384 0.674 . . . . 0.0 111.345 179.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.667 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 30.6 Cg_endo -70.2 172.39 13.15 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 122.259 1.973 . . . . 0.0 111.984 177.525 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.64 ' HG2' ' HB1' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -56.51 -24.17 44.57 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.307 1.043 . . . . 0.0 113.623 -172.924 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.408 ' HG3' ' HD2' ' A' ' 78' ' ' LYS . 0.4 OUTLIER -109.83 -46.07 3.55 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.086 0.554 . . . . 0.0 110.918 176.154 . . . . . . . . 3 3 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.3 0 C-N-CA 125.097 1.359 . . . . 0.0 114.015 -179.489 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.616 ' HA ' ' HB2' ' A' ' 28' ' ' ASP . 45.8 mtt . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.4 p -119.68 125.65 49.22 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.01 0.924 . . . . 0.0 110.399 -175.021 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.447 ' HB2' HD13 ' A' ' 25' ' ' LEU . . . -99.69 135.65 40.79 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.529 0.732 . . . . 0.0 109.948 -176.544 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -108.19 126.81 53.22 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.485 ' HB ' HG11 ' A' ' 74' ' ' VAL . 57.0 mt -107.32 120.98 59.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.625 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 173.972 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -144.86 173.1 12.15 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.442 ' HD3' ' HB3' ' A' ' 77' ' ' PRO . 59.9 ttt180 -141.38 94.38 7.62 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.371 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -91.7 161.24 3.47 Favored 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 123.365 2.71 . . . . 0.0 113.021 -169.964 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.22 -30.76 48.98 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.152 172.366 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -135.74 145.02 46.18 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.875 0.87 . . . . 0.0 110.247 177.124 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.6 t -175.93 -170.88 0.41 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.444 1.098 . . . . 0.0 108.439 -173.887 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 103.75 0.42 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 165.236 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -82.89 39.39 0.63 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.298 1.039 . . . . 0.0 111.695 -173.439 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -123.33 164.41 18.86 Favored 'General case' 0 C--O 1.245 0.834 0 C-N-CA 124.845 1.258 . . . . 0.0 108.962 176.871 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.7 m 69.38 -69.28 0.17 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 125.152 1.381 . . . . 0.0 110.487 -176.848 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -87.71 66.04 3.45 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 116.638 -0.256 . . . . 0.0 112.881 176.077 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 31.0 p -92.2 54.27 2.32 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.628 0.771 . . . . 0.0 110.021 177.571 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.96 168.82 16.65 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.516 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -61.77 -42.1 98.55 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.246 0.618 . . . . 0.0 110.519 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.6 p -100.78 167.08 10.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.128 0.971 . . . . 0.0 110.083 173.637 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -66.04 139.04 58.17 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 168.404 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.4 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 20.9 m -113.1 175.18 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.334 0.654 . . . . 0.0 110.351 -178.82 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -85.15 121.71 28.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -177.433 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.483 HG23 HG23 ' A' ' 54' ' ' THR . 53.1 t -100.21 136.53 31.18 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.447 HD13 ' HB2' ' A' ' 3' ' ' ALA . 56.2 tp -116.77 106.28 13.31 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.878 1.271 . . . . 0.0 108.336 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -112.38 133.7 54.33 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.444 ' CE2' ' HA ' ' A' ' 29' ' ' ALA . 12.4 p90 -145.85 155.98 43.26 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 118.372 0.533 . . . . 0.0 110.87 -177.34 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.616 ' HB2' ' HA ' ' A' ' 1' ' ' MET . 3.6 m-20 -61.52 97.94 0.08 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 167.343 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.444 ' HA ' ' CE2' ' A' ' 27' ' ' PHE . . . -67.81 139.91 56.61 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 123.882 0.738 . . . . 0.0 110.749 -171.083 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -75.09 64.39 1.38 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 122.234 1.016 . . . . 0.0 110.64 -179.148 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.0 p -147.85 119.26 4.49 Favored Pre-proline 0 CA--C 1.549 0.918 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 -176.381 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 83.4 Cg_endo -77.83 -156.03 0.06 OUTLIER 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 122.639 2.226 . . . . 0.0 111.438 -178.829 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -21.77 20.42 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.322 0.649 . . . . 0.0 112.048 172.312 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -77.88 72.4 4.41 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.919 0.888 . . . . 0.0 108.917 173.26 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.6 pp -96.03 -171.57 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.747 0.819 . . . . 0.0 109.979 177.837 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -60.1 122.01 63.23 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 123.342 0.657 . . . . 0.0 111.502 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.58 -10.13 26.79 Favored 'Trans proline' 0 C--N 1.382 2.326 0 C-N-CA 122.806 2.337 . . . . 0.0 112.774 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.0 mm -56.42 -42.91 76.27 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 124.472 1.109 . . . . 0.0 110.163 172.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 53.8 mtm -120.66 28.11 8.15 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.283 1.033 . . . . 0.0 109.744 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -85.94 -2.21 86.39 Favored Glycine 0 C--N 1.347 1.152 0 N-CA-C 114.968 0.747 . . . . 0.0 114.968 -171.661 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -72.91 83.02 1.21 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 117.69 0.745 . . . . 0.0 110.062 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.431 HG21 ' HG ' ' A' ' 45' ' ' SER . 3.6 t -173.24 115.73 0.26 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.688 1.195 . . . . 0.0 108.097 -179.151 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.1 m -59.38 -47.71 84.39 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.229 0.612 . . . . 0.0 111.345 -175.621 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 42.7 t -100.47 97.59 8.3 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' SER . . . . . 0.431 ' HG ' HG21 ' A' ' 42' ' ' THR . 24.8 m -82.98 -178.74 7.23 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.672 0.789 . . . . 0.0 110.741 178.588 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -66.35 131.52 46.27 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.924 0.49 . . . . 0.0 110.078 175.003 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -61.57 -38.12 86.34 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 170.16 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.58 132.55 9.7 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 169.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -96.99 116.11 28.63 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.767 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.2 mp0 -71.32 91.33 0.98 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.272 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.432 HG22 ' HB1' ' A' ' 29' ' ' ALA . 22.2 m -88.85 168.52 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.152 0.981 . . . . 0.0 109.879 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -137.55 147.69 45.34 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.927 0.87 . . . . 0.0 112.309 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.94 156.69 29.11 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 113.721 -1.581 . . . . 0.0 107.136 176.591 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.483 HG23 HG23 ' A' ' 24' ' ' VAL . 12.2 p -122.76 128.6 50.69 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.419 0.554 . . . . 0.0 110.372 176.31 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.4 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 97.9 m-85 -128.62 152.15 48.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.379 1.472 . . . . 0.0 108.534 -178.248 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -65.96 -33.63 76.27 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.888 0.375 . . . . 0.0 111.302 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 65.1 p -134.33 159.32 41.37 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.52 0.728 . . . . 0.0 110.694 -173.686 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -58.45 -44.84 89.35 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.54 1.136 . . . . 0.0 111.419 174.243 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -50.36 -43.11 54.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.322 . . . . 0.0 112.798 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -70.99 -31.68 68.29 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.013 0.525 . . . . 0.0 111.964 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.53 -40.31 57.16 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.78 0.432 . . . . 0.0 111.088 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -72.45 -33.87 67.35 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.773 177.632 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.2 -41.25 75.29 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.08 0.552 . . . . 0.0 111.427 173.763 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -67.08 -58.79 4.22 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 123.314 0.645 . . . . 0.0 110.387 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -50.85 -51.48 50.95 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.79 1.236 . . . . 0.0 112.744 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -63.6 -40.02 95.86 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.698 0.799 . . . . 0.0 111.816 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -54.45 -37.15 64.85 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.615 1.166 . . . . 0.0 110.855 174.289 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.542 ' HB2' HG13 ' A' ' 70' ' ' ILE . 33.0 mmtp -90.43 -20.06 23.19 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.497 0.719 . . . . 0.0 111.686 -178.441 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.57 1.86 60.28 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-O 119.891 -0.394 . . . . 0.0 113.14 -176.406 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.542 HG13 ' HB2' ' A' ' 68' ' ' LYS . 10.7 mt -64.25 108.71 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-O 120.956 0.408 . . . . 0.0 110.439 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -56.43 139.2 49.78 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.152 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -148.14 153.09 38.37 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.794 0.724 . . . . 0.0 111.179 -170.408 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . 0.424 ' NH1' HG13 ' A' ' 75' ' ' ILE . 6.2 tmm_? -133.92 146.81 50.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 169.539 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.485 HG11 ' HB ' ' A' ' 5' ' ' ILE . 19.8 m -106.36 140.91 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.746 0.784 . . . . 0.0 111.747 -173.834 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.424 HG13 ' NH1' ' A' ' 73' ' ' ARG . 3.3 mp -109.35 141.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 125.803 1.641 . . . . 0.0 107.088 173.517 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.6 mt -65.42 151.21 94.72 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 122.761 0.424 . . . . 0.0 111.531 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.442 ' HB3' ' HD3' ' A' ' 7' ' ' ARG . 40.6 Cg_endo -67.34 169.78 14.77 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 122.662 2.242 . . . . 0.0 114.049 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . 0.672 ' HB2' ' HZ3' ' A' ' 78' ' ' LYS . 0.0 OUTLIER -70.09 -20.63 63.19 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.361 175.7 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.437 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 1.0 OUTLIER -100.49 8.95 43.21 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.276 1.03 . . . . 0.0 111.683 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.943 0 C-N-CA 123.419 0.688 . . . . 0.0 109.628 173.714 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.5 mtm . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 p -135.61 106.79 6.75 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 -176.647 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.63 137.12 39.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.909 0.484 . . . . 0.0 111.189 -166.112 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.85 132.11 54.45 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.827 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.493 HG23 ' HG3' ' A' ' 58' ' ' GLN . 40.2 mt -112.57 123.98 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.667 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.45 175.29 12.0 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.741 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 40.7 ttt-85 -136.74 97.17 11.45 Favored Pre-proline 0 N--CA 1.479 0.992 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.258 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -78.68 167.65 22.19 Favored 'Trans proline' 0 C--N 1.371 1.717 0 C-N-CA 123.253 2.635 . . . . 0.0 112.638 -170.745 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.11 -36.32 72.1 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.255 0.622 . . . . 0.0 110.658 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.84 121.33 41.21 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 171.307 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.8 m -123.04 123.03 39.95 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.747 1.219 . . . . 0.0 109.358 -174.567 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.14 148.79 32.22 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.712 0.405 . . . . 0.0 110.316 177.357 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.02 121.14 33.31 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -81.75 -34.43 30.45 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.065 0.546 . . . . 0.0 110.126 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.0 t -153.5 57.07 0.76 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 121.496 0.665 . . . . 0.0 109.25 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.81 33.94 88.57 Favored Glycine 0 C--N 1.349 1.3 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.909 -175.344 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.0 p -104.4 21.79 16.05 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.428 1.091 . . . . 0.0 112.734 -168.411 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -140.87 88.4 2.18 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 120.745 0.307 . . . . 0.0 110.722 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -81.73 -41.02 21.86 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.339 0.656 . . . . 0.0 109.592 172.044 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.5 p -134.21 -80.42 0.46 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.309 1.043 . . . . 0.0 108.399 174.796 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -146.14 131.51 18.6 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.968 0.907 . . . . 0.0 109.323 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.445 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 16.8 m -122.66 176.47 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 166.79 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -86.94 130.32 34.51 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -177.11 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.1 t -101.29 137.54 28.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 54.2 tp -115.27 105.09 12.47 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 177.377 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -118.58 130.17 55.74 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.441 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -138.59 155.34 48.42 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 118.401 0.546 . . . . 0.0 111.561 -173.875 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.34 94.89 0.18 Allowed 'General case' 0 C--O 1.237 0.438 0 O-C-N 124.092 0.87 . . . . 0.0 109.868 168.892 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.541 ' HB2' ' HG3' ' A' ' 49' ' ' GLN . . . -74.92 99.99 3.98 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.196 179.431 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.493 ' HA ' ' HG3' ' A' ' 48' ' ' LYS . 10.0 pt-20 -67.77 96.28 0.56 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.722 -178.674 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.5 p -111.19 99.49 43.61 Favored Pre-proline 0 CA--C 1.554 1.114 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.178 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -83.32 -144.13 0.03 OUTLIER 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 123.133 2.555 . . . . 0.0 110.563 171.946 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -4.14 0.15 Allowed 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -59.38 -6.9 1.12 Allowed 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.21 1.004 . . . . 0.0 113.649 174.132 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 1.9 pp -54.95 98.55 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.127 0 CA-C-O 121.564 0.697 . . . . 0.0 109.367 165.674 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -56.1 133.91 74.56 Favored Pre-proline 0 N--CA 1.476 0.845 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.775 -170.343 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.13 -14.81 15.93 Favored 'Trans proline' 0 C--N 1.382 2.311 0 C-N-CA 123.142 2.561 . . . . 0.0 112.936 172.773 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.4 mm -60.39 -39.76 82.0 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 C-N-CA 124.086 0.954 . . . . 0.0 110.246 171.412 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 78.7 mtp -113.88 97.14 6.21 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.149 0.979 . . . . 0.0 109.136 173.838 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.66 99.8 0.24 Allowed Glycine 0 C--N 1.348 1.246 0 O-C-N 123.352 0.408 . . . . 0.0 113.019 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -128.86 15.01 6.39 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.842 0.857 . . . . 0.0 110.07 -178.121 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.4 p -69.95 -8.76 51.55 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.76 0.824 . . . . 0.0 112.961 -175.762 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.0 m -71.47 -18.3 62.31 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.612 0.765 . . . . 0.0 111.867 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.8 m -143.66 104.59 4.22 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 123.387 0.675 . . . . 0.0 110.554 177.941 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 t -94.37 88.29 5.48 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 171.803 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -81.0 145.55 31.12 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.455 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -73.77 89.84 1.83 Allowed 'General case' 0 C--O 1.246 0.875 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.651 179.294 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.493 ' HG3' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER 61.38 -170.57 0.16 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.93 1.292 . . . . 0.0 111.797 177.143 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . 0.541 ' HG3' ' HB2' ' A' ' 29' ' ' ALA . 12.7 pt20 -151.39 -170.57 3.69 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.174 0.99 . . . . 0.0 108.335 173.765 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -140.06 113.99 8.88 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 173.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.8 m -108.66 166.49 4.46 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 C-N-CA 124.016 0.927 . . . . 0.0 109.491 172.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.61 150.48 37.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.336 1.065 . . . . 0.0 113.361 -173.056 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -121.68 159.15 27.14 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 113.532 -1.667 . . . . 0.0 107.599 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 p -122.28 129.87 52.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.081 0.953 . . . . 0.0 110.309 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.455 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 94.9 m-85 -130.54 148.93 52.4 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.268 1.427 . . . . 0.0 108.171 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.99 -29.65 70.07 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 120.906 0.384 . . . . 0.0 110.477 -176.066 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.8 p -133.07 159.66 39.44 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.2 1.0 . . . . 0.0 110.134 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.493 ' HG3' HG23 ' A' ' 5' ' ' ILE . 41.0 tt0 -59.99 -41.17 91.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.7 0.8 . . . . 0.0 110.864 171.871 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -50.48 -45.57 56.37 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 124.559 1.162 . . . . 0.0 112.201 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.455 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 48.8 mt-30 -67.32 -32.54 73.57 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.178 0.591 . . . . 0.0 111.385 -178.571 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.18 -42.95 54.73 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.058 0.543 . . . . 0.0 111.459 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -75.08 -39.22 60.94 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.844 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.29 71.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.518 0.727 . . . . 0.0 111.661 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . 0.5 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 14.9 t80 -66.91 -56.64 9.39 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.942 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.83 -45.66 70.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.086 0.954 . . . . 0.0 112.529 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -62.03 -43.93 97.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.487 1.115 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -57.23 -34.52 68.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.703 1.201 . . . . 0.0 111.646 176.972 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.621 ' HB2' HG13 ' A' ' 70' ' ' ILE . 11.7 mmmm -92.22 -16.88 25.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.13 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 88.48 1.5 80.85 Favored Glycine 0 C--N 1.35 1.35 0 O-C-N 123.616 0.573 . . . . 0.0 112.849 -173.533 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.621 HG13 ' HB2' ' A' ' 68' ' ' LYS . 73.0 mt -57.95 114.94 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.259 0.623 . . . . 0.0 110.988 -179.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -57.61 131.2 49.51 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 113.942 -1.481 . . . . 0.0 108.543 169.692 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.7 p90 -144.01 147.97 34.61 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-O 121.272 0.558 . . . . 0.0 111.43 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -117.6 123.06 45.26 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.343 172.225 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.9 t -80.19 124.2 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 170.309 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -107.87 120.44 59.23 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 169.417 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.3 mt -58.8 149.36 64.59 Favored Pre-proline 0 CA--C 1.544 0.748 0 O-C-N 123.185 0.303 . . . . 0.0 110.28 176.662 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.741 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 40.7 Cg_endo -65.51 163.25 30.59 Favored 'Trans proline' 0 C--N 1.363 1.306 0 C-N-CA 122.252 1.968 . . . . 0.0 112.233 -177.945 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -30.47 62.6 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.078 0.951 . . . . 0.0 111.306 178.203 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.422 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 6.8 pt-20 -76.76 -24.22 52.95 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.402 1.081 . . . . 0.0 111.462 -175.313 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.995 0 C-N-CA 123.517 0.727 . . . . 0.0 112.329 -175.555 . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.472 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.5 mpt? . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 m -116.62 116.9 28.44 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -171.142 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.458 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -100.89 123.79 45.61 Favored 'General case' 0 C--O 1.218 -0.589 0 C-N-CA 123.146 0.578 . . . . 0.0 109.899 -172.069 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -107.18 119.26 38.91 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 91.5 mt -105.09 121.19 56.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.432 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.7 p90 -152.15 177.49 10.47 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.501 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 21.7 ttt180 -143.52 97.5 5.52 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.623 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -64.71 132.55 33.2 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 122.675 2.25 . . . . 0.0 112.085 -174.913 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.53 -33.86 74.54 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.649 0.779 . . . . 0.0 110.525 173.616 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -152.13 149.31 28.65 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.8 t -156.18 176.25 12.91 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 122.846 0.458 . . . . 0.0 111.001 -169.643 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.13 -0.02 57.62 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.866 0.866 . . . . 0.0 111.56 177.014 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.454 ' HE3' ' HD3' ' A' ' 52' ' ' LYS . 22.1 mmt -65.18 94.31 0.15 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.274 0.63 . . . . 0.0 110.324 178.232 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -77.01 102.42 6.44 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.634 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.8 t -158.5 -174.2 4.67 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.346 0.658 . . . . 0.0 109.903 -171.811 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -85.35 35.36 3.17 Favored Glycine 0 C--N 1.351 1.402 0 CA-C-N 116.811 -0.177 . . . . 0.0 113.177 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.4 p -88.86 78.28 7.61 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.512 0.725 . . . . 0.0 109.899 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.78 122.3 34.19 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.742 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.1 tttt 68.42 -72.9 0.09 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.18 1.392 . . . . 0.0 111.185 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 p -75.02 129.86 38.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.856 0.462 . . . . 0.0 110.466 177.644 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -87.49 -176.87 5.75 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.341 1.056 . . . . 0.0 111.127 -175.028 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.4 p -131.42 156.24 42.49 Favored 'Isoleucine or valine' 0 C--O 1.246 0.914 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.56 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -85.3 133.39 34.15 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.3 t -102.31 137.24 30.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.201 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.402 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 2.8 tt -115.72 106.61 14.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 175.643 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -116.89 131.17 57.02 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 -177.52 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.458 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 43.1 p90 -145.76 158.79 43.83 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.334 0.654 . . . . 0.0 110.522 179.583 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.597 ' HB3' ' HZ2' ' A' ' 48' ' ' LYS . 4.9 m-20 -54.21 105.41 0.14 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 114.378 -1.283 . . . . 0.0 108.284 170.51 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -40.44 122.57 1.62 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.719 1.208 . . . . 0.0 112.304 -177.778 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -70.47 76.79 0.57 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 122.344 1.068 . . . . 0.0 110.67 -178.085 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.8 p -148.42 134.14 9.6 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.54 -178.746 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.21 -168.78 0.22 Allowed 'Trans proline' 0 C--N 1.372 1.804 0 C-N-CA 122.491 2.127 . . . . 0.0 111.883 173.295 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.77 3.09 3.46 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -70.44 75.77 0.56 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.33 1.052 . . . . 0.0 109.2 169.035 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 23.3 pt -125.06 165.91 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 124.848 1.259 . . . . 0.0 108.894 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -67.6 117.85 51.5 Favored Pre-proline 0 CA--C 1.544 0.734 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 175.401 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.06 -18.35 57.41 Favored 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 122.543 2.162 . . . . 0.0 112.179 173.378 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.9 mm -64.19 -46.38 93.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 124.172 0.989 . . . . 0.0 110.812 174.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 70.5 mtm -114.27 15.2 18.14 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.616 0.766 . . . . 0.0 111.073 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.477 ' HA2' ' HB2' ' A' ' 44' ' ' SER . . . -86.17 46.88 3.67 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 116.249 -0.432 . . . . 0.0 113.389 -175.82 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -161.13 -37.68 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.9 0.88 . . . . 0.0 109.528 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 18.7 p -83.54 -71.92 0.48 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.765 0.826 . . . . 0.0 110.597 176.114 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -71.58 -44.11 65.09 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.793 0.837 . . . . 0.0 110.415 -177.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' SER . . . . . 0.477 ' HB2' ' HA2' ' A' ' 40' ' ' GLY . 18.4 m -107.08 82.46 1.69 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 175.568 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.3 m -66.78 -23.63 66.09 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.711 0.805 . . . . 0.0 111.82 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -129.7 -150.97 0.45 Allowed 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.041 0.937 . . . . 0.0 109.348 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 52.5 ttm -51.91 -27.57 13.42 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.343 1.057 . . . . 0.0 112.891 176.536 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.597 ' HZ2' ' HB3' ' A' ' 28' ' ' ASP . 4.9 pttp -149.96 -172.04 4.06 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.883 0.873 . . . . 0.0 110.309 -166.233 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -124.61 -160.01 0.91 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.786 0.834 . . . . 0.0 108.828 175.866 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -104.8 154.75 19.62 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 121.049 0.452 . . . . 0.0 110.34 174.192 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.6 p -139.01 142.85 32.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.035 0.934 . . . . 0.0 108.951 174.332 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.454 ' HD3' ' HE3' ' A' ' 13' ' ' MET . 14.5 ptpt -137.75 133.11 33.72 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.592 0.711 . . . . 0.0 112.233 -175.833 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.4 mp -119.45 151.09 39.13 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.191 1.396 . . . . 0.0 107.652 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.2 p -118.26 132.54 56.3 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 118.564 0.62 . . . . 0.0 111.243 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -132.7 149.53 52.28 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.247 1.419 . . . . 0.0 108.938 -177.787 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -68.91 -28.19 66.45 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.936 0.494 . . . . 0.0 111.901 -176.138 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.0 p -134.64 162.14 33.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.442 0.697 . . . . 0.0 110.909 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.74 -43.0 98.46 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.622 0.769 . . . . 0.0 111.011 171.857 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -57.1 -37.5 72.03 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.225 0.953 . . . . 0.0 111.779 -175.562 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.4 mt-30 -72.91 -32.81 65.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.999 0.52 . . . . 0.0 111.442 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.73 -39.06 57.88 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 -177.301 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.11 -32.29 63.15 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.952 176.915 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.67 -37.91 66.33 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.359 0.663 . . . . 0.0 111.693 174.175 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -65.34 -59.78 3.67 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.643 0.777 . . . . 0.0 110.416 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.88 70.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.394 1.077 . . . . 0.0 112.767 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -63.01 -39.71 95.56 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.162 0.985 . . . . 0.0 111.287 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -53.82 -38.22 64.38 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.316 1.046 . . . . 0.0 111.322 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . 0.453 ' HB2' HG13 ' A' ' 70' ' ' ILE . 79.7 mttt -93.27 -18.03 22.94 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.921 -176.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.69 6.76 76.19 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.195 -172.635 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.453 HG13 ' HB2' ' A' ' 68' ' ' LYS . 67.7 mt -60.5 113.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -56.62 129.97 43.26 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.111 -1.858 . . . . 0.0 108.666 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -141.17 140.23 34.0 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.692 -0.63 . . . . 0.0 111.746 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.2 tpp85 -104.74 122.99 46.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.692 1.197 . . . . 0.0 108.937 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.1 t -85.12 125.88 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.432 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.7 mp -108.41 125.35 65.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 C-N-CA 125.397 1.479 . . . . 0.0 107.107 170.205 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.7 mt -78.26 141.12 61.62 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 122.288 0.235 . . . . 0.0 111.092 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.501 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 67.9 Cg_endo -83.69 -169.7 0.74 Allowed 'Trans proline' 0 C--N 1.366 1.469 0 C-N-CA 123.464 2.776 . . . . 0.0 112.913 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -12.78 61.36 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.853 0.861 . . . . 0.0 112.364 179.134 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . 0.414 ' HG3' ' H ' ' A' ' 80' ' ' ALA . 6.9 pt-20 -109.02 -65.1 1.17 Allowed 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.08 0.952 . . . . 0.0 110.037 -177.659 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.414 ' H ' ' HG3' ' A' ' 79' ' ' GLU . . . . . . . . 0 N--CA 1.481 1.083 0 C-N-CA 125.578 1.551 . . . . 0.0 113.025 172.554 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.51 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.9 OUTLIER . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 . . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.2 p -134.18 95.74 3.48 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -167.439 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.472 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -98.02 145.07 26.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.055 -172.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -113.84 125.28 53.9 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 168.122 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.501 ' HB ' HG11 ' A' ' 74' ' ' VAL . 91.6 mt -107.07 121.49 59.98 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . 0.428 ' HA ' ' O ' ' A' ' 75' ' ' ILE . 30.5 p90 -149.1 174.91 11.82 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -126.26 99.95 30.27 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 175.535 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.413 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 72.3 Cg_endo -70.01 126.65 13.38 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 123.022 2.481 . . . . 0.0 112.865 -172.501 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.51 -47.52 60.06 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.648 0.779 . . . . 0.0 109.1 170.263 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -90.2 117.32 28.86 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 170.435 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.2 t -158.21 165.3 35.23 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.48 0.712 . . . . 0.0 110.237 -176.734 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.67 100.28 0.52 Allowed 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.4 ptp -63.18 127.75 32.69 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.475 0.71 . . . . 0.0 110.811 -175.112 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.6 tm0? -65.11 -59.95 3.56 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 175.059 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.0 t -178.68 -49.24 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.373 1.069 . . . . 0.0 108.814 177.937 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 136.9 -24.32 3.15 Favored Glycine 0 N--CA 1.473 1.128 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.645 -177.14 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.4 t -67.02 -32.12 73.13 Favored 'General case' 0 CA--C 1.55 0.981 0 C-N-CA 123.408 0.683 . . . . 0.0 111.19 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.69 179.29 5.41 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.604 0.762 . . . . 0.0 109.75 171.28 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . 0.592 ' HE2' HG11 ' A' ' 22' ' ' VAL . 34.5 mtmm -65.99 -27.73 68.36 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -173.614 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 64.4 p 60.58 -69.74 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 126.286 1.834 . . . . 0.0 112.42 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -72.93 88.77 1.38 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 171.376 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.592 HG11 ' HE2' ' A' ' 19' ' ' LYS . 27.0 m -107.39 175.33 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 172.661 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -87.96 125.89 34.76 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 118.819 0.736 . . . . 0.0 109.448 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 76.1 t -101.39 138.97 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.414 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 9.4 tt -115.22 107.21 14.99 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -116.37 130.4 56.75 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.448 ' O ' ' HA ' ' A' ' 50' ' ' GLN . 45.1 p90 -141.09 154.39 45.9 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 -175.955 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.09 128.29 37.88 Favored 'General case' 0 C--O 1.241 0.643 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 169.785 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.25 159.44 25.9 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.678 0.751 . . . . 0.0 111.805 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.58 7.93 7.39 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 114.177 -1.374 . . . . 0.0 111.622 178.553 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.573 ' HB ' ' HG2' ' A' ' 48' ' ' LYS . 9.3 p -47.59 127.66 10.56 Favored Pre-proline 0 CA--C 1.564 1.487 0 C-N-CA 123.872 0.869 . . . . 0.0 112.384 174.323 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.81 170.37 18.92 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.652 2.235 . . . . 0.0 111.991 175.767 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -62.93 -26.82 68.99 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.854 175.588 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -78.1 99.09 6.02 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.629 0.772 . . . . 0.0 109.897 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 10.9 pt -123.7 179.74 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 124.319 1.048 . . . . 0.0 110.237 -179.111 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -60.26 123.15 71.74 Favored Pre-proline 0 N--CA 1.482 1.163 0 C-N-CA 123.109 0.564 . . . . 0.0 111.239 -177.404 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -55.17 -26.07 49.26 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 124.028 3.152 . . . . 0.0 114.044 176.817 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.4 mt -81.86 -82.55 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 123.113 0.565 . . . . 0.0 110.563 -173.305 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 24.9 ptm -92.95 4.29 54.23 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.808 0.443 . . . . 0.0 112.079 -173.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.93 -13.51 61.78 Favored Glycine 0 N--CA 1.478 1.477 0 N-CA-C 113.869 0.307 . . . . 0.0 113.869 177.92 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -56.42 -36.42 68.94 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.652 0.781 . . . . 0.0 110.347 171.126 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 16.7 p -111.78 99.65 8.31 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.371 1.068 . . . . 0.0 108.672 171.686 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.1 t -63.6 -15.45 58.2 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.221 1.009 . . . . 0.0 112.41 -174.891 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.1 t -65.53 85.79 0.07 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.718 0.807 . . . . 0.0 110.713 176.213 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.6 m -147.51 -173.8 4.36 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.774 0.83 . . . . 0.0 110.666 -175.12 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -75.4 -17.85 60.09 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.619 0.768 . . . . 0.0 111.128 172.838 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -58.81 135.89 57.62 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 167.44 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.573 ' HG2' ' HB ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -48.68 133.64 16.88 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 124.16 0.912 . . . . 0.0 111.131 174.328 . . . . . . . . 3 3 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -157.39 -162.12 1.15 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.297 1.039 . . . . 0.0 109.053 -173.477 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.448 ' HA ' ' O ' ' A' ' 27' ' ' PHE . 25.7 pt20 -75.47 56.89 0.89 Allowed 'General case' 0 CA--C 1.564 1.483 0 C-N-CA 123.094 0.558 . . . . 0.0 111.358 175.243 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.5 t -68.41 160.84 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 124.67 1.188 . . . . 0.0 112.33 -167.844 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.414 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 13.2 ptmm? -131.88 136.82 47.72 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.223 171.511 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.3 mp -120.12 144.63 47.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.354 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 19.2 p -111.8 128.86 56.24 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.085 0.554 . . . . 0.0 109.806 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -125.3 156.56 38.45 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 125.05 1.34 . . . . 0.0 108.943 -178.306 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.36 -42.0 97.99 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.246 1.018 . . . . 0.0 111.696 177.108 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.0 p -136.5 168.11 20.1 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 124.013 0.925 . . . . 0.0 110.014 -173.958 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -63.33 -37.38 87.04 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.484 173.701 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -58.55 -41.24 85.15 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 124.148 0.905 . . . . 0.0 111.815 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -70.36 -29.51 66.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.978 0.511 . . . . 0.0 111.817 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.72 -41.22 38.56 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.088 0.555 . . . . 0.0 110.747 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.52 -38.66 65.25 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.648 -177.467 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.78 -36.12 73.91 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 0.0 112.02 172.205 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -64.61 -58.26 6.82 Favored 'General case' 0 C--N 1.349 0.548 0 O-C-N 123.68 0.612 . . . . 0.0 110.011 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.55 -50.06 66.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.607 1.163 . . . . 0.0 112.382 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -60.59 -42.33 96.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.672 0.789 . . . . 0.0 111.163 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -61.93 -30.34 70.84 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.773 1.229 . . . . 0.0 111.152 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.61 -14.29 26.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.291 0.636 . . . . 0.0 111.274 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.39 2.03 83.13 Favored Glycine 0 C--N 1.351 1.374 0 O-C-N 123.15 0.281 . . . . 0.0 113.018 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . 0.403 HG12 ' HB2' ' A' ' 1' ' ' MET . 61.1 mt -62.23 111.91 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 CA-C-O 121.522 0.677 . . . . 0.0 111.121 178.72 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -61.23 133.31 55.78 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 113.434 -1.712 . . . . 0.0 108.528 169.895 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . 0.472 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 53.7 p90 -138.77 143.59 39.03 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.055 0.843 . . . . 0.0 112.652 -171.927 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -110.19 110.57 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.912 1.285 . . . . 0.0 108.567 173.744 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.501 HG11 ' HB ' ' A' ' 5' ' ' ILE . 27.3 m -83.88 128.94 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . 0.428 ' O ' ' HA ' ' A' ' 6' ' ' TYR . 4.2 mp -119.55 126.37 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 172.739 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.492 ' HB3' ' HB1' ' A' ' 80' ' ' ALA . 45.3 mt -76.56 159.91 78.4 Favored Pre-proline 0 CA--C 1.546 0.811 0 CA-C-O 119.298 -0.382 . . . . 0.0 110.247 177.984 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -61.23 166.89 10.19 Favored 'Trans proline' 0 C--N 1.381 2.249 0 C-N-CA 121.939 1.759 . . . . 0.0 111.337 175.075 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.45 11.78 0.16 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 -169.461 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -145.04 13.93 1.47 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.922 0.889 . . . . 0.0 111.418 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.492 ' HB1' ' HB3' ' A' ' 76' ' ' LEU . . . . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -175.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.465 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.3 mpt? . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 . . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 p -123.72 126.81 47.19 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.354 0.662 . . . . 0.0 110.376 -176.124 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.83 139.24 36.8 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.328 0.651 . . . . 0.0 110.111 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . 0.504 ' HZ3' ' HB3' ' A' ' 4' ' ' LYS . 0.3 OUTLIER -107.46 127.32 53.5 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.451 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.452 HG22 ' HG3' ' A' ' 58' ' ' GLN . 61.1 mt -107.09 122.94 61.87 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -147.19 176.58 9.86 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.509 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 64.6 ttt180 -141.52 96.02 7.05 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 175.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo -74.19 -179.3 4.58 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 122.842 2.361 . . . . 0.0 112.754 -170.66 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.01 2.89 56.57 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.318 177.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 7.5 ptpp? -147.44 157.73 43.69 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.605 0.762 . . . . 0.0 110.582 174.244 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.6 p -142.32 -52.38 0.4 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 172.809 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -162.1 -65.83 0.05 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 170.609 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 99.0 mmm -146.2 164.93 30.71 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 125.629 1.571 . . . . 0.0 107.089 165.735 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -71.61 88.99 0.97 Allowed 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.019 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.2 t -160.73 136.89 8.44 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 123.585 0.754 . . . . 0.0 109.042 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.66 31.39 78.36 Favored Glycine 0 C--N 1.345 1.066 0 O-C-N 123.539 0.525 . . . . 0.0 112.66 -176.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' THR . . . . . 0.547 HG21 HG13 ' A' ' 22' ' ' VAL . 33.9 p -122.4 142.16 50.82 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.006 0.922 . . . . 0.0 110.158 -176.832 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.65 93.29 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.367 0.667 . . . . 0.0 110.993 175.718 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -160.83 128.16 4.26 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.5 p 50.46 -85.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 125.131 1.372 . . . . 0.0 112.731 178.961 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -124.33 154.66 39.98 Favored 'General case' 0 C--N 1.349 0.56 0 C-N-CA 124.28 1.032 . . . . 0.0 108.31 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . 0.547 HG13 HG21 ' A' ' 17' ' ' THR . 3.6 m -88.4 170.44 1.25 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.782 0 CA-C-O 121.139 0.495 . . . . 0.0 110.793 176.219 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -84.06 122.21 28.48 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . 0.493 HG21 HG22 ' A' ' 54' ' ' THR . 56.0 t -100.93 138.72 24.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.53 -177.088 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -117.43 105.06 11.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -117.11 130.18 56.46 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.3 p90 -143.97 156.94 44.6 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 123.105 0.562 . . . . 0.0 110.224 -177.28 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . 0.601 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 34.6 t70 -61.12 105.71 0.52 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 168.709 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.672 ' HB2' HG13 ' A' ' 31' ' ' VAL . . . -55.0 124.8 17.92 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 124.272 0.982 . . . . 0.0 111.669 -170.228 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -86.62 29.08 0.81 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.439 0.695 . . . . 0.0 110.127 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.672 HG13 ' HB2' ' A' ' 29' ' ' ALA . 10.1 p -128.72 123.51 22.13 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 123.41 0.684 . . . . 0.0 110.355 -173.636 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.433 ' HB2' ' HD3' ' A' ' 33' ' ' ARG . 44.5 Cg_endo -87.18 -148.47 0.03 OUTLIER 'Trans proline' 0 C--N 1.371 1.711 0 C-N-CA 123.188 2.592 . . . . 0.0 110.705 166.141 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.433 ' HD3' ' HB2' ' A' ' 32' ' ' PRO . 0.0 OUTLIER -55.42 -30.17 59.95 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.361 0.664 . . . . 0.0 112.301 169.435 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -77.94 90.79 4.15 Favored 'General case' 0 C--N 1.356 0.861 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.677 ' HB ' ' HA2' ' A' ' 40' ' ' GLY . 2.7 pp -99.25 153.36 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 114.91 -1.041 . . . . 0.0 112.175 -169.926 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -76.25 145.55 76.67 Favored Pre-proline 0 N--CA 1.477 0.923 0 C-N-CA 122.693 0.397 . . . . 0.0 110.14 171.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.55 -5.77 16.07 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 122.487 2.124 . . . . 0.0 112.411 173.368 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.2 mm -64.05 -75.15 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.495 0.718 . . . . 0.0 109.668 173.304 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 61.9 mtm -94.5 -71.77 0.65 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.677 ' HA2' ' HB ' ' A' ' 35' ' ' ILE . . . 63.53 24.06 67.42 Favored Glycine 0 C--N 1.348 1.21 0 N-CA-C 115.309 0.884 . . . . 0.0 115.309 171.336 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -95.6 10.81 35.43 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 117.278 0.539 . . . . 0.0 111.394 -177.594 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 17.0 m -82.84 61.7 6.03 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-O 122.218 1.009 . . . . 0.0 109.491 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.5 m -74.64 -12.24 60.39 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.261 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.0 p -55.56 -44.85 77.23 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.878 1.271 . . . . 0.0 111.105 175.318 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.5 t 63.49 12.45 6.4 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.569 1.148 . . . . 0.0 112.029 177.919 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -92.24 77.59 5.21 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.27 0.628 . . . . 0.0 110.187 -170.722 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 63.02 -75.21 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 125.188 1.395 . . . . 0.0 111.172 -178.546 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.498 ' HZ1' ' HB3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -165.38 145.32 6.8 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.683 1.193 . . . . 0.0 109.086 169.781 . . . . . . . . 3 3 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -100.43 -153.6 0.45 Allowed 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 174.35 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.601 ' HG2' ' HA ' ' A' ' 28' ' ' ASP . 46.9 mt-30 -123.77 100.49 6.8 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 165.519 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.421 ' H ' ' HB1' ' A' ' 29' ' ' ALA . 31.0 m -82.57 164.02 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 118.17 0.441 . . . . 0.0 111.022 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -146.17 142.84 28.85 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.164 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp -116.77 158.58 23.66 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.819 1.648 . . . . 0.0 108.106 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' THR . . . . . 0.493 HG22 HG21 ' A' ' 24' ' ' VAL . 17.0 p -122.84 133.87 54.42 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.656 0.782 . . . . 0.0 110.973 175.492 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . 0.404 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 98.8 m-85 -135.15 153.06 52.11 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.277 1.031 . . . . 0.0 109.897 -178.679 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . 0.419 ' HB2' HE22 ' A' ' 60' ' ' GLN . 6.2 mm-40 -62.85 -32.42 73.64 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.26 0.624 . . . . 0.0 111.356 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 34.6 p -135.5 162.11 33.6 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.734 0.814 . . . . 0.0 111.127 -174.984 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . 0.452 ' HG3' HG22 ' A' ' 5' ' ' ILE . 41.6 tt0 -58.43 -41.9 86.09 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.705 170.667 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -49.36 -47.7 47.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.137 1.375 . . . . 0.0 112.563 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . 0.419 HE22 ' HB2' ' A' ' 56' ' ' GLU . 50.9 mt-30 -69.32 -30.73 68.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.458 0.703 . . . . 0.0 111.7 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.6 -42.51 51.73 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.893 0.477 . . . . 0.0 111.139 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -72.18 -39.27 68.78 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.455 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.37 74.96 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 122.775 0.43 . . . . 0.0 111.956 176.247 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -66.13 -56.58 10.73 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.617 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.26 -48.71 68.03 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.468 1.107 . . . . 0.0 111.903 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -64.66 -40.42 95.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.821 0.848 . . . . 0.0 111.514 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -56.09 -35.51 67.11 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.928 1.291 . . . . 0.0 111.081 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -85.75 -23.11 27.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.789 0.836 . . . . 0.0 110.844 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.56 -0.75 65.7 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-O 120.089 -0.284 . . . . 0.0 112.415 -172.787 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 50.9 mt -65.44 108.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.09 139.75 40.45 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.173 -1.831 . . . . 0.0 108.74 169.001 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -136.58 145.59 45.13 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 118.866 0.757 . . . . 0.0 111.657 -171.963 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -118.21 130.0 55.82 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.703 1.201 . . . . 0.0 108.438 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 48.6 t -102.43 132.52 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 121.81 67.81 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.9 mt -62.18 137.11 95.72 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 122.777 0.431 . . . . 0.0 111.265 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.509 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 84.8 Cg_endo -81.39 179.22 5.99 Favored 'Trans proline' 0 C--N 1.363 1.311 0 C-N-CA 123.356 2.704 . . . . 0.0 114.229 -178.601 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -22.6 66.19 Favored 'General case' 0 CA--C 1.553 1.066 0 CA-C-N 114.169 -1.378 . . . . 0.0 112.669 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -127.15 53.71 1.7 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 122.277 1.037 . . . . 0.0 109.376 173.831 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.863 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.64 177.835 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 67.1 mtm . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.9 m -127.21 112.35 15.01 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 175.348 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.85 127.62 44.83 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -169.853 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -109.5 122.1 46.66 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.488 HG13 HD22 ' A' ' 25' ' ' LEU . 3.6 mp -103.6 119.79 52.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 42.8 p90 -143.84 176.45 9.24 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.914 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.632 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 78.2 ttt180 -142.68 100.81 5.53 Favored Pre-proline 0 C--N 1.314 -0.954 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -72.77 127.57 12.44 Favored 'Trans proline' 0 C--N 1.368 1.568 0 C-N-CA 122.089 1.859 . . . . 0.0 110.625 -177.193 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.61 -29.65 69.74 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.324 0.583 . . . . 0.0 109.743 171.32 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.1 6.0 38.46 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.469 1.108 . . . . 0.0 112.706 -178.903 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.6 t -68.4 -28.75 67.37 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.552 0.615 . . . . 0.0 111.176 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -161.33 162.29 30.81 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.616 1.166 . . . . 0.0 109.297 179.09 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.5 ptp -63.52 107.56 1.16 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.353 0.661 . . . . 0.0 110.334 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -63.32 102.1 0.37 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.864 0.866 . . . . 0.0 110.835 -179.442 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.7 t -91.14 29.64 1.37 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.914 0.885 . . . . 0.0 111.233 -173.573 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.71 32.18 74.05 Favored Glycine 0 C--N 1.349 1.265 0 CA-C-N 116.383 -0.371 . . . . 0.0 112.604 -176.005 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.1 t -143.8 157.8 44.13 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 123.676 0.79 . . . . 0.0 110.17 -177.382 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . 0.456 ' HB3' HH22 ' A' ' 7' ' ' ARG . . . -74.56 -29.38 61.33 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.064 178.276 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -61.33 -36.22 79.54 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.214 0.606 . . . . 0.0 112.14 -175.714 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.3 p -70.54 -5.44 28.98 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -127.55 110.23 12.51 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 171.208 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.7 m -105.77 165.16 3.96 Favored 'Isoleucine or valine' 0 C--O 1.245 0.864 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . 0.431 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 66.4 m95 -90.35 131.83 35.92 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.856 0.862 . . . . 0.0 109.039 -176.742 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -100.08 139.3 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.257 177.521 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.488 HD22 HG13 ' A' ' 5' ' ' ILE . 3.4 tm? -111.34 105.2 13.78 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 175.001 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . 0.617 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 1.8 tm-20 -116.25 124.44 50.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 -174.602 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -140.9 153.27 45.61 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.317 0.962 . . . . 0.0 111.667 -174.835 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -59.6 90.91 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.545 1.138 . . . . 0.0 110.444 170.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.459 ' HB1' HG21 ' A' ' 51' ' ' VAL . . . -76.87 92.35 3.63 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.819 0.848 . . . . 0.0 110.776 -175.122 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.3 pt-20 -79.47 61.82 3.62 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 122.173 0.987 . . . . 0.0 110.213 175.336 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.4 p -66.77 123.95 87.28 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.101 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -76.34 109.34 2.85 Favored 'Trans proline' 0 C--N 1.361 1.215 0 C-N-CA 121.919 1.746 . . . . 0.0 110.838 173.135 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -40.41 8.72 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -177.84 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm 60.87 89.91 0.07 Allowed 'General case' 0 C--N 1.354 0.763 0 O-C-N 125.087 1.492 . . . . 0.0 110.697 176.381 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.634 ' HA ' ' SD ' ' A' ' 39' ' ' MET . 2.8 pp -61.1 133.06 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-O 121.4 0.619 . . . . 0.0 111.179 -173.921 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -119.41 150.74 50.23 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.451 1.1 . . . . 0.0 108.678 -173.293 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -43.24 -37.4 7.0 Favored 'Trans proline' 0 C--N 1.379 2.14 0 C-N-CA 123.818 3.012 . . . . 0.0 114.274 172.01 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.8 mm -73.16 -30.72 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 123.017 0.527 . . . . 0.0 110.899 -178.246 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.634 ' SD ' ' HA ' ' A' ' 35' ' ' ILE . 64.9 mtt -62.22 -49.83 74.2 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.552 0.341 . . . . 0.0 110.097 173.105 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.16 -32.47 2.02 Favored Glycine 0 CA--C 1.537 1.427 0 N-CA-C 115.626 1.01 . . . . 0.0 115.626 170.538 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 2.3 p90 -84.35 47.18 1.31 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.999 0.919 . . . . 0.0 111.757 -169.368 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.6 m -61.4 -26.42 67.84 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.873 0.869 . . . . 0.0 111.921 -174.035 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.6 p -74.32 -43.24 57.5 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.78 0.432 . . . . 0.0 111.174 175.283 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.9 m -93.17 10.32 32.24 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.195 0.598 . . . . 0.0 112.511 -176.47 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.3 p -71.63 92.94 1.2 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.571 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -76.46 172.2 13.34 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.348 -174.461 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.5 ptp -71.66 177.77 3.94 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.217 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.404 ' HB2' ' O ' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -56.54 145.4 28.21 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.926 0.89 . . . . 0.0 111.84 175.735 . . . . . . . . 3 3 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -99.39 -165.11 1.19 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.785 176.298 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -137.37 117.57 13.53 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.456 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.459 HG21 ' HB1' ' A' ' 29' ' ' ALA . 32.1 m -106.5 168.54 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.138 0.975 . . . . 0.0 110.825 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.617 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 4.5 ptpp? -133.72 142.7 48.08 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.234 1.016 . . . . 0.0 112.356 -171.946 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . 0.462 HD13 HD13 ' A' ' 25' ' ' LEU . 48.9 mt -118.56 154.0 33.31 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.944 1.698 . . . . 0.0 107.213 177.404 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 p -121.36 130.91 53.88 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.06 0.845 . . . . 0.0 110.134 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -129.1 153.49 47.61 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.836 1.655 . . . . 0.0 108.549 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -67.0 -32.9 74.45 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.789 0.436 . . . . 0.0 111.835 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.5 p -134.69 160.61 37.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.415 0.686 . . . . 0.0 111.226 -175.195 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -58.84 -45.53 89.84 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.224 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -50.42 -42.43 53.87 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.635 1.174 . . . . 0.0 112.831 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -71.26 -30.89 66.85 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.173 0.589 . . . . 0.0 112.17 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.41 -39.79 24.41 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.413 0.685 . . . . 0.0 111.188 -178.239 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -76.37 -39.87 52.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 114.636 -1.165 . . . . 0.0 111.229 -178.04 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.91 -25.88 65.71 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.423 0.689 . . . . 0.0 111.599 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -65.36 -52.44 53.68 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.05 -46.47 75.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.089 0.956 . . . . 0.0 111.415 176.297 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -58.73 -47.44 84.59 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.424 1.09 . . . . 0.0 111.222 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.0 ttm-85 -59.46 -32.46 70.26 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.136 1.375 . . . . 0.0 111.576 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -94.54 -12.2 28.04 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.422 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.97 -4.97 81.94 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-O 119.921 -0.377 . . . . 0.0 112.732 -178.187 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.44 113.65 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.947 0 C-N-CA 123.656 0.782 . . . . 0.0 110.883 -177.06 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -55.82 134.17 51.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 113.433 -1.712 . . . . 0.0 108.648 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -143.06 149.8 38.69 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 118.237 0.471 . . . . 0.0 110.81 -174.325 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -133.51 141.17 47.63 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 171.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.434 HG13 ' HB ' ' A' ' 5' ' ' ILE . 18.0 m -103.86 139.97 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-O 121.131 0.491 . . . . 0.0 111.18 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.4 mp -109.29 121.94 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 171.786 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 mt -76.17 142.2 71.68 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 122.77 0.428 . . . . 0.0 111.169 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.632 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 72.1 Cg_endo -76.74 -174.02 1.98 Allowed 'Trans proline' 0 C--N 1.373 1.826 0 C-N-CA 123.234 2.623 . . . . 0.0 112.947 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -34.3 78.12 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.677 -176.197 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -82.98 -53.58 5.72 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.729 0.812 . . . . 0.0 109.444 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.428 ' H ' ' HG2' ' A' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 125.357 1.463 . . . . 0.0 113.873 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.486 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.3 mpt? . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 t -140.11 166.17 25.39 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.193 -1.039 . . . . 0.0 108.193 -169.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.94 156.15 24.44 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -173.718 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -113.0 126.36 55.42 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.924 1.29 . . . . 0.0 109.099 164.705 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.1 mt -103.21 129.6 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 171.582 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -154.03 -179.14 7.6 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 123.857 0.863 . . . . 0.0 109.552 176.113 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.53 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 37.1 ttt180 -141.39 99.36 6.43 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 106.957 -1.497 . . . . 0.0 106.957 174.254 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . 0.53 ' HG2' ' HA ' ' A' ' 11' ' ' THR . 56.1 Cg_endo -66.86 125.95 14.53 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.713 2.275 . . . . 0.0 112.523 -172.021 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.26 83.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.956 0.902 . . . . 0.0 110.263 175.674 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -71.55 -29.08 64.33 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.676 0.791 . . . . 0.0 110.77 174.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' THR . . . . . 0.53 ' HA ' ' HG2' ' A' ' 8' ' ' PRO . 18.8 m 66.69 -74.5 0.06 Allowed 'General case' 0 C--N 1.355 0.837 0 C-N-CA 125.441 1.496 . . . . 0.0 111.727 -178.186 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.81 125.06 22.69 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.745 0.818 . . . . 0.0 110.974 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' MET . . . . . 0.552 ' SD ' ' HE3' ' A' ' 52' ' ' LYS . 52.8 mtt -106.68 -40.32 5.57 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.78 0.832 . . . . 0.0 108.808 177.06 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -160.67 87.49 0.75 Allowed 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 114.952 -1.022 . . . . 0.0 108.594 170.331 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -167.54 -34.35 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.824 0.85 . . . . 0.0 110.525 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.93 47.45 9.46 Favored Glycine 0 C--N 1.35 1.332 0 O-C-N 123.323 0.389 . . . . 0.0 112.489 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.1 p -103.95 166.58 10.32 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.109 0.964 . . . . 0.0 110.425 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.28 160.46 32.35 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.276 175.864 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.8 mppt? -77.56 78.29 4.07 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.078 0.551 . . . . 0.0 109.954 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' THR . . . . . 0.466 HG23 HG23 ' A' ' 11' ' ' THR . 8.9 t -84.84 -27.52 26.69 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.51 0.724 . . . . 0.0 110.335 178.541 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 62.89 94.48 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.178 1.391 . . . . 0.0 111.382 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.1 p -115.07 146.51 19.41 Favored 'Isoleucine or valine' 0 C--O 1.245 0.844 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 172.721 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -75.93 125.8 29.8 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -173.105 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 90.9 t -102.07 139.22 23.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.11 105.97 13.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 169.071 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -104.32 133.35 49.36 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.479 ' O ' ' HA ' ' A' ' 50' ' ' GLN . 27.9 p90 -144.98 149.52 35.32 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.019 -175.278 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.6 91.28 0.02 OUTLIER 'General case' 0 C--O 1.242 0.687 0 O-C-N 124.411 1.07 . . . . 0.0 109.093 165.833 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . 0.511 ' HB2' HG21 ' A' ' 51' ' ' VAL . . . -73.53 136.77 44.11 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.646 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -11.93 61.24 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.35 1.06 . . . . 0.0 111.734 176.55 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . 0.597 HG11 ' HA ' ' A' ' 48' ' ' LYS . 3.0 p -23.53 96.77 0.06 OUTLIER Pre-proline 0 N--CA 1.493 1.723 0 C-N-CA 126.647 1.979 . . . . 0.0 114.288 -173.664 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -87.16 -161.67 0.13 Allowed 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 123.581 2.854 . . . . 0.0 111.843 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -32.03 73.42 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.296 171.024 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -74.8 87.92 2.26 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 123.781 0.833 . . . . 0.0 110.711 -179.468 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . 0.575 HD11 ' HA3' ' A' ' 40' ' ' GLY . 19.7 pt -137.17 -163.83 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 124.595 1.158 . . . . 0.0 108.458 175.784 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . 0.633 ' HB2' ' HG2' ' A' ' 39' ' ' MET . 7.8 m-20 -51.69 124.92 27.72 Favored Pre-proline 0 N--CA 1.476 0.86 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.23 175.371 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.4 -16.45 29.11 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 123.256 2.638 . . . . 0.0 112.983 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 42.8 mm -71.05 -49.57 48.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 124.807 1.243 . . . . 0.0 111.275 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' MET . . . . . 0.633 ' HG2' ' HB2' ' A' ' 36' ' ' ASP . 27.3 ptm -110.37 153.28 25.17 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -169.166 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . 0.575 ' HA3' HD11 ' A' ' 35' ' ' ILE . . . 84.71 -11.18 60.09 Favored Glycine 0 C--N 1.351 1.404 0 N-CA-C 115.068 0.787 . . . . 0.0 115.068 169.791 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -91.47 6.1 46.85 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 117.336 0.568 . . . . 0.0 111.538 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.2 p -66.75 159.92 26.89 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.483 0.713 . . . . 0.0 110.907 170.738 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.5 t -58.33 -40.08 81.18 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.716 0.806 . . . . 0.0 110.972 -179.337 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 60.3 p -93.78 86.91 5.25 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 172.415 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.9 p -101.18 130.18 47.23 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 123.74 0.816 . . . . 0.0 109.823 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -86.62 135.73 33.31 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.264 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -71.61 -175.37 1.32 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.479 0.712 . . . . 0.0 111.568 -176.756 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.597 ' HA ' HG11 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -61.04 143.72 54.83 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.267 178.741 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -155.14 177.56 11.2 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.651 0.78 . . . . 0.0 110.255 -169.433 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . 0.479 ' HA ' ' O ' ' A' ' 27' ' ' PHE . 25.3 mp0 -85.41 103.06 13.96 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 122.874 0.47 . . . . 0.0 110.291 -179.281 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . 0.511 HG21 ' HB2' ' A' ' 29' ' ' ALA . 16.6 m -100.21 168.79 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 172.188 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.552 ' HE3' ' SD ' ' A' ' 13' ' ' MET . 23.5 pttm -144.14 148.33 34.91 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.93 0.871 . . . . 0.0 113.263 -167.569 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.7 mp -120.99 155.65 33.83 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.85 -1.523 . . . . 0.0 107.855 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -118.15 130.66 56.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.348 0.659 . . . . 0.0 110.252 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.75 153.05 48.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.358 1.463 . . . . 0.0 109.206 -175.334 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 14.7 mm-40 -72.01 -29.86 64.63 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.187 0.595 . . . . 0.0 111.745 -179.062 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.9 p -136.44 163.42 30.52 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.431 0.692 . . . . 0.0 110.758 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -57.5 -44.58 85.12 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.796 0.838 . . . . 0.0 110.615 172.162 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . 0.48 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 41.8 mt-10 -56.61 -39.09 72.99 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 124.677 1.235 . . . . 0.0 111.969 -174.919 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 78.6 mt-30 -64.04 -39.66 94.57 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.484 0.714 . . . . 0.0 111.541 175.096 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.4 -40.05 62.27 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.302 0.641 . . . . 0.0 111.768 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . 0.48 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.7 pt-20 -76.82 -43.01 38.18 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.135 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.99 -27.21 65.49 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 123.168 0.587 . . . . 0.0 111.431 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -64.21 -54.31 35.48 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 172.694 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.33 -48.41 74.22 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.586 1.154 . . . . 0.0 111.833 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -60.7 -43.9 97.21 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.421 1.088 . . . . 0.0 111.432 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -64.0 -28.1 69.58 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.587 1.155 . . . . 0.0 111.552 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.87 -13.53 27.1 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.264 0.626 . . . . 0.0 111.116 177.622 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.02 -1.12 82.8 Favored Glycine 0 C--N 1.354 1.529 0 O-C-N 123.332 0.395 . . . . 0.0 113.252 -176.349 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.8 mt -63.17 110.67 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.294 0 CA-C-O 121.836 0.827 . . . . 0.0 110.807 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -65.68 137.28 57.21 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.352 -1.749 . . . . 0.0 109.137 171.595 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -140.44 149.76 42.98 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.669 0.668 . . . . 0.0 112.486 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -108.52 111.59 23.53 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.164 0.986 . . . . 0.0 109.5 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 76.7 t -79.64 118.22 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.477 0.711 . . . . 0.0 109.819 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 27.6 mt -122.86 97.48 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.438 1.495 . . . . 0.0 107.495 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . 0.409 ' HB3' ' HB2' ' A' ' 80' ' ' ALA . 62.8 mt -68.38 146.39 97.84 Favored Pre-proline 0 CA--C 1.554 1.109 0 C-N-CA 123.264 0.626 . . . . 0.0 112.386 -173.831 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.53 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 72.9 Cg_endo -73.28 177.92 7.27 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.312 2.675 . . . . 0.0 113.487 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -65.27 -23.44 67.04 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -169.823 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -99.6 -12.11 20.37 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 122.568 0.347 . . . . 0.0 111.731 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . 0.409 ' HB2' ' HB3' ' A' ' 76' ' ' LEU . . . . . . . . 0 N--CA 1.484 1.26 0 C-N-CA 122.844 0.457 . . . . 0.0 111.708 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.422 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.4 mpt? . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m -121.06 121.34 37.7 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.827 0.851 . . . . 0.0 109.078 -177.151 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' ALA . . . . . 0.476 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.28 128.84 47.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.234 0.614 . . . . 0.0 109.998 -174.806 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -109.04 123.79 49.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 176.698 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' ILE . . . . . 0.512 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.7 mp -109.17 121.14 61.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -148.42 170.87 17.05 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -172.911 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' ARG . . . . . 0.722 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 58.0 ttt180 -139.36 96.3 8.86 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.32 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -73.72 167.0 28.34 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.488 2.125 . . . . 0.0 112.023 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.66 -39.3 73.69 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.752 0.421 . . . . 0.0 109.986 175.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -86.8 146.56 26.19 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.289 173.792 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 p -160.17 -172.76 3.73 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 125.003 1.321 . . . . 0.0 108.741 179.32 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.31 -179.83 6.5 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 122.705 0.402 . . . . 0.0 110.113 169.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 66.3 mtm -89.73 -177.61 5.31 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.598 0.759 . . . . 0.0 111.599 -175.869 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -67.5 110.99 3.87 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.428 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.6 p -160.48 176.5 11.56 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 122.814 0.446 . . . . 0.0 110.953 -171.305 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.79 -23.0 76.11 Favored Glycine 0 C--N 1.345 1.063 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.13 172.761 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.9 t -84.99 -25.3 27.82 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.454 0.702 . . . . 0.0 111.648 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -142.78 128.9 19.73 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.907 0.483 . . . . 0.0 111.656 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -83.71 57.39 4.07 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.257 1.023 . . . . 0.0 109.812 176.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.3 m 67.76 -69.85 0.13 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.301 1.441 . . . . 0.0 112.173 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -142.79 115.74 8.8 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.377 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.3 m -132.68 -177.25 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.005 0.922 . . . . 0.0 110.614 -177.235 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -88.79 129.1 35.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.414 1.085 . . . . 0.0 108.86 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -101.35 137.28 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.423 ' HG ' HG13 ' A' ' 5' ' ' ILE . 5.6 tt -112.45 108.56 17.74 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 175.017 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -114.14 132.7 55.98 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' PHE . . . . . 0.476 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 3.3 p90 -144.79 157.77 44.04 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.555 0.693 . . . . 0.0 112.615 -178.318 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -59.54 110.43 1.12 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 106.166 -1.79 . . . . 0.0 106.166 160.535 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.49 143.13 36.32 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -168.31 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.26 11.82 2.19 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.557 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.4 p -153.1 140.14 12.94 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 124.49 1.116 . . . . 0.0 108.41 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' PRO . . . . . 0.523 ' HA ' ' HA ' ' A' ' 48' ' ' LYS . 74.4 Cg_endo -72.25 -174.46 1.41 Allowed 'Trans proline' 0 C--N 1.375 1.959 0 C-N-CA 122.223 1.948 . . . . 0.0 111.589 169.297 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' ARG . . . . . 0.536 ' HG3' ' HA ' ' A' ' 42' ' ' THR . 0.0 OUTLIER -62.14 -28.6 69.76 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.482 0.658 . . . . 0.0 109.985 167.618 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -81.89 95.22 7.28 Favored 'General case' 0 C--N 1.35 0.618 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.801 -170.613 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 12.7 pt -98.92 -100.86 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 161.12 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -75.6 158.24 83.35 Favored Pre-proline 0 CA--C 1.55 0.953 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 154.752 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -64.11 -4.64 8.0 Favored 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 122.557 2.171 . . . . 0.0 113.81 176.775 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.5 mm -54.34 -36.52 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 125.107 1.363 . . . . 0.0 112.194 177.046 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 80.8 mtp -82.37 63.38 6.52 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-O 121.565 0.697 . . . . 0.0 111.703 178.532 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.62 10.37 43.56 Favored Glycine 0 C--N 1.352 1.42 0 CA-C-N 114.722 -1.126 . . . . 0.0 115.595 171.371 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 61.64 -73.65 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.888 1.275 . . . . 0.0 110.143 -171.224 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' THR . . . . . 0.536 ' HA ' ' HG3' ' A' ' 33' ' ' ARG . 8.1 t -152.01 117.5 5.34 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.391 1.077 . . . . 0.0 109.539 170.046 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.2 m -73.89 -49.11 26.41 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.541 0.736 . . . . 0.0 111.454 -176.432 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.6 t -151.77 50.19 0.8 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.264 0.625 . . . . 0.0 110.512 -176.381 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.5 m 56.32 53.43 8.8 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.074 0.949 . . . . 0.0 110.413 178.331 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ASP . . . . . 0.405 ' HB2' ' HD2' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -86.96 83.76 7.45 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 114.671 -1.15 . . . . 0.0 109.503 -167.916 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 55.6 tpp -58.61 -31.57 68.21 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-O 121.429 0.633 . . . . 0.0 109.953 175.263 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HA ' ' HA ' ' A' ' 32' ' ' PRO . 0.0 OUTLIER -145.19 157.48 44.07 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.132 166.515 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -100.75 -161.01 0.83 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 170.832 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -119.85 144.92 47.1 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 168.238 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.2 t -134.72 146.53 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' LYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 6.5 ptpp? -138.8 134.48 33.46 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.331 172.917 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.24 159.88 18.87 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.952 1.301 . . . . 0.0 107.749 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -125.82 129.82 50.16 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.17 0.509 . . . . 0.0 110.118 170.417 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -127.04 150.36 49.48 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.547 1.539 . . . . 0.0 108.734 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -72.43 -26.15 61.74 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.412 0.685 . . . . 0.0 111.763 -176.647 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.1 p -130.34 159.78 35.93 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.453 0.701 . . . . 0.0 109.619 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -62.71 -39.26 93.47 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.495 171.423 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -55.33 -41.12 72.02 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.367 1.042 . . . . 0.0 111.874 -176.077 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -68.21 -32.78 73.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.099 0.56 . . . . 0.0 111.395 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.45 -41.44 21.82 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.506 0.723 . . . . 0.0 111.326 -175.934 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.39 -38.91 74.76 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.843 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.36 71.09 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.159 0.584 . . . . 0.0 112.078 175.058 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -63.33 -59.15 5.09 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.73 73.7 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.12 0.968 . . . . 0.0 111.662 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -65.86 -42.65 90.16 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.178 0.991 . . . . 0.0 111.799 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -55.66 -38.34 69.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.566 1.146 . . . . 0.0 110.684 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -80.77 -26.41 37.27 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.823 0.849 . . . . 0.0 110.754 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.86 -5.26 69.07 Favored Glycine 0 C--N 1.349 1.301 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.541 -169.741 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.68 112.13 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-O 121.437 0.637 . . . . 0.0 110.644 -178.09 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.95 135.34 36.82 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 113.149 -1.841 . . . . 0.0 108.821 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -143.04 145.93 33.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.428 0.558 . . . . 0.0 111.207 -170.627 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -125.64 114.01 18.14 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' VAL . . . . . 0.512 HG12 ' HB ' ' A' ' 5' ' ' ILE . 24.5 m -84.53 139.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.92 0.488 . . . . 0.0 111.077 177.522 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.83 126.29 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.469 1.508 . . . . 0.0 107.412 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.8 mt -69.14 144.01 94.76 Favored Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 122.927 0.491 . . . . 0.0 110.535 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' PRO . . . . . 0.722 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 81.7 Cg_endo -79.08 177.05 9.11 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 122.84 2.36 . . . . 0.0 112.901 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -16.66 64.32 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.537 172.355 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -112.34 41.35 2.02 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.292 1.437 . . . . 0.0 109.316 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 O-C-N 121.534 -0.729 . . . . 0.0 112.759 -176.674 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.6 p . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 120.396 0.141 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -102.6 127.53 49.65 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.844 0.858 . . . . 0.0 109.172 175.734 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB2' HD13 ' A' ' 75' ' ' ILE . 17.2 ptpt -108.72 124.23 50.23 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -177.833 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.462 HG13 HD13 ' A' ' 25' ' ' LEU . 4.0 mp -107.87 121.24 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.483 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.9 p90 -150.59 160.05 44.08 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.429 0.633 . . . . 0.0 112.132 -173.483 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.9 mtp180 -122.16 96.61 46.3 Favored Pre-proline 0 N--CA 1.478 0.97 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 168.256 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 CA--C 1.552 1.424 0 C-N-CA 122.623 2.215 . . . . 0.0 111.676 178.297 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 C--O 1.249 1.076 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -82.51 125.43 31.11 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 177.284 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.9 t -100.07 135.97 33.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.53 HD11 ' HB1' ' A' ' 3' ' ' ALA . 51.2 tp -116.37 104.0 11.03 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 36.6 tt0 -104.97 135.92 45.41 Favored 'General case' 0 C--O 1.214 -0.772 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 176.841 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.6 p90 . . . . . 0 C--O 1.239 0.537 0 CA-C-N 118.559 0.618 . . . . 0.0 111.876 -178.642 . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.6 m . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -142.9 149.28 38.26 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-O 122.025 0.917 . . . . 0.0 113.437 -173.44 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.42 HD12 HD23 ' A' ' 25' ' ' LEU . 50.5 mt -119.2 158.9 25.06 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.522 1.929 . . . . 0.0 107.588 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.1 p -122.31 129.05 51.78 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 118.43 0.559 . . . . 0.0 110.622 175.049 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -130.63 148.53 52.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.258 1.423 . . . . 0.0 108.936 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.09 -22.36 62.11 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.771 0.428 . . . . 0.0 111.579 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.3 p -132.47 157.21 45.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.217 0.607 . . . . 0.0 111.169 178.17 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -58.82 -43.85 90.71 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.276 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -59.05 -35.54 73.52 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.687 1.242 . . . . 0.0 111.494 -175.047 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -74.03 -30.02 62.21 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.076 0.551 . . . . 0.0 112.04 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.33 -37.83 31.79 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.366 0.603 . . . . 0.0 110.903 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -71.92 -37.71 70.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.368 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.39 70.61 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.645 0.778 . . . . 0.0 112.171 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -61.3 -60.3 3.94 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.073 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB1' ' O ' ' A' ' 70' ' ' ILE . . . -51.99 -47.69 64.76 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.973 1.309 . . . . 0.0 112.046 -177.761 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -60.81 -46.47 90.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.369 1.068 . . . . 0.0 111.341 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.7 ttt85 -63.36 -31.81 73.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.588 1.155 . . . . 0.0 111.396 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.21 -14.81 35.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.177 0.591 . . . . 0.0 111.462 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.04 -3.4 76.93 Favored Glycine 0 C--N 1.35 1.348 0 C-N-CA 122.823 0.249 . . . . 0.0 112.789 -176.336 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.407 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 59.3 mt -69.29 106.46 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -55.1 143.88 25.65 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.397 170.528 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -135.8 146.84 47.97 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.61 0.641 . . . . 0.0 112.116 -170.836 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -114.36 125.36 53.78 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 171.249 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 90.9 t -90.45 126.73 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 110.16 175.393 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.483 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 mp -105.93 112.39 39.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 170.381 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 72.0 mt . . . . . 0 CA--C 1.547 0.863 0 C-N-CA 123.633 0.773 . . . . 0.0 111.665 179.756 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.8 p . . . . . 0 N--CA 1.474 0.76 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.49 134.59 44.35 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.87 0.468 . . . . 0.0 110.908 -167.629 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.56 122.82 48.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 176.882 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.513 ' HB ' HG12 ' A' ' 74' ' ' VAL . 5.1 mp -107.21 122.57 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -147.78 172.99 13.24 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -175.46 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.5 ttp180 -116.48 119.99 35.31 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 170.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.503 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 29.6 Cg_endo . . . . . 0 CA--C 1.55 1.319 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.503 ' O ' ' HD2' ' A' ' 8' ' ' PRO . 28.8 m . . . . . 0 N--CA 1.47 0.544 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.7 m95 -93.11 132.75 36.96 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.39 0.676 . . . . 0.0 109.319 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.487 HG22 HG22 ' A' ' 54' ' ' THR . 70.3 t -102.54 138.66 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 tt -112.99 108.26 17.1 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -119.94 131.15 55.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.433 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 35.0 p90 . . . . . 0 N--CA 1.472 0.64 0 C-N-CA 123.522 0.729 . . . . 0.0 111.058 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.5 136.03 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.676 0.75 . . . . 0.0 111.363 -175.444 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.5 mp -123.81 153.91 40.33 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.591 1.556 . . . . 0.0 107.448 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.487 HG22 HG22 ' A' ' 24' ' ' VAL . 17.1 p -120.54 125.18 47.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.381 0.991 . . . . 0.0 111.154 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -124.44 145.49 49.47 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.905 1.682 . . . . 0.0 107.448 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -69.99 -22.63 63.12 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -172.933 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 45.1 p -135.72 162.38 32.93 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 110.146 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -61.64 -40.93 96.66 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.57 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -59.49 -39.54 84.09 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.713 0.805 . . . . 0.0 111.585 -175.007 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -67.7 -33.21 74.45 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.936 0.495 . . . . 0.0 111.337 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.03 -39.68 25.43 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.148 0.499 . . . . 0.0 111.046 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.38 -39.0 63.0 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.305 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.29 -32.34 73.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.485 0.714 . . . . 0.0 111.76 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -66.69 -49.25 66.7 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.16 84.07 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.094 0.958 . . . . 0.0 111.187 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -62.64 -42.96 99.89 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.957 0.903 . . . . 0.0 111.324 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -55.48 -36.74 66.94 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.965 1.306 . . . . 0.0 110.825 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -87.09 -21.0 26.3 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.041 -0.982 . . . . 0.0 110.882 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.62 -10.68 66.74 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.265 -0.742 . . . . 0.0 112.536 -174.503 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 52.7 mt -52.63 114.3 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.818 0.847 . . . . 0.0 111.512 -173.224 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -58.14 130.4 46.44 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 113.861 -1.518 . . . . 0.0 108.739 170.274 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -142.16 146.64 35.53 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.045 0.45 . . . . 0.0 111.509 -169.875 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -114.86 133.81 55.66 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.683 1.193 . . . . 0.0 107.797 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.513 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.7 m -103.32 127.48 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-O 121.389 0.614 . . . . 0.0 109.426 174.545 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.26 132.25 68.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 C-N-CA 125.432 1.493 . . . . 0.0 107.282 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 34.4 mt . . . . . 0 C--O 1.24 0.564 0 O-C-N 122.997 0.186 . . . . 0.0 110.573 173.84 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 50.4 m . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 . . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.11 136.41 41.0 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.965 0.506 . . . . 0.0 109.716 -173.935 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -108.24 123.55 48.95 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.481 HG12 HD13 ' A' ' 25' ' ' LEU . 59.3 mt -104.29 121.04 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.225 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -146.59 176.63 9.68 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -136.41 94.62 13.55 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.075 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo . . . . . 0 C--N 1.368 1.587 0 C-N-CA 123.483 2.789 . . . . 0.0 111.559 -172.981 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 111.547 0.203 . . . . 0.0 111.547 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -84.88 129.54 34.79 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.9 t -102.74 138.49 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.396 0.617 . . . . 0.0 109.739 175.988 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.481 HD13 HG12 ' A' ' 5' ' ' ILE . 60.4 tp -116.06 105.49 12.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -114.41 131.11 56.7 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.4 p90 . . . . . 0 C--O 1.235 0.317 0 C-N-CA 124.236 1.014 . . . . 0.0 110.713 178.21 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.472 0.638 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -142.62 136.25 28.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.631 0.729 . . . . 0.0 111.377 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.4 mp -121.64 147.59 45.66 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 113.866 -1.516 . . . . 0.0 107.2 -178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.4 p -113.16 132.55 55.43 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.261 0.624 . . . . 0.0 110.186 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.7 m-85 -132.85 148.24 52.3 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.298 1.439 . . . . 0.0 108.509 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.411 ' HB2' HE22 ' A' ' 60' ' ' GLN . 44.0 mt-10 -70.15 -26.75 64.08 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 123.283 0.364 . . . . 0.0 111.915 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 58.6 p -133.17 163.27 29.66 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.05 0.54 . . . . 0.0 110.096 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -62.13 -39.1 91.42 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 114.959 -1.018 . . . . 0.0 110.828 171.263 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -53.06 -43.16 66.47 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.473 1.109 . . . . 0.0 111.469 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.489 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 64.3 mt-30 -67.74 -36.25 80.21 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.064 0.945 . . . . 0.0 111.395 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.03 -39.7 55.1 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.973 0.509 . . . . 0.0 111.127 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -70.85 -37.48 73.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.562 177.007 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.37 -38.72 69.21 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.523 0.729 . . . . 0.0 111.925 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -63.39 -60.62 3.14 Favored 'General case' 0 C--N 1.351 0.64 0 C-N-CA 123.325 0.65 . . . . 0.0 110.005 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.41 -47.41 66.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.489 1.115 . . . . 0.0 112.293 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -61.9 -45.8 92.17 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.006 0.922 . . . . 0.0 111.452 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -59.72 -34.37 72.84 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.081 0.952 . . . . 0.0 110.936 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -86.87 -20.56 27.26 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.333 0.653 . . . . 0.0 111.407 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.18 2.05 74.73 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 116.643 -0.253 . . . . 0.0 112.786 -173.842 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.97 110.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 122.568 0.347 . . . . 0.0 110.179 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.6 pt-20 -58.58 136.93 57.71 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 124.95 1.407 . . . . 0.0 108.407 170.494 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -144.42 151.52 39.36 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.357 0.526 . . . . 0.0 110.997 -171.906 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.459 ' NH1' HG13 ' A' ' 75' ' ' ILE . 3.5 tmt_? -125.44 140.34 52.86 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.516 1.127 . . . . 0.0 108.26 171.4 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -105.57 136.84 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.352 0.661 . . . . 0.0 111.032 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.459 HG13 ' NH1' ' A' ' 73' ' ' ARG . 2.3 mp -111.26 150.47 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.4 mt . . . . . 0 CA--C 1.556 1.205 0 C-N-CA 122.841 0.457 . . . . 0.0 110.987 173.959 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.9 m . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.684 0.278 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -102.31 144.39 30.86 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -107.71 124.92 50.73 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.62 HG21 ' HG2' ' A' ' 58' ' ' GLN . 70.3 mt -103.28 123.71 56.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.315 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 172.073 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -148.46 176.22 10.49 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.347 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -141.68 97.52 6.59 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 174.099 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo . . . . . 0 C--N 1.36 1.136 0 C-N-CA 121.715 1.61 . . . . 0.0 111.714 -176.108 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.7 m . . . . . 0 N--CA 1.474 0.768 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -85.17 132.17 34.33 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.6 t -101.06 139.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.13 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.516 HD23 HG12 ' A' ' 5' ' ' ILE . 3.4 tm? -116.84 104.6 11.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -107.81 137.48 45.75 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.4 p90 . . . . . 0 N--CA 1.476 0.86 0 C-N-CA 123.174 0.59 . . . . 0.0 109.9 -178.887 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.4 t . . . . . 0 C--O 1.24 0.568 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -137.44 146.54 44.47 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.772 0.796 . . . . 0.0 111.628 -173.723 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp -119.61 157.27 28.77 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.978 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 48.5 p -121.73 131.6 54.17 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 110.193 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -128.17 147.49 50.56 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.503 1.521 . . . . 0.0 107.982 178.587 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.05 -24.21 64.15 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.656 0.382 . . . . 0.0 111.84 -176.736 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 79.8 p -132.99 160.5 36.96 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 123.927 0.891 . . . . 0.0 110.193 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.62 ' HG2' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -60.88 -40.41 92.91 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.078 0.951 . . . . 0.0 110.317 170.803 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -57.3 -39.7 76.32 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.75 1.22 . . . . 0.0 111.754 -174.573 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -70.93 -30.78 67.19 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 122.963 0.505 . . . . 0.0 112.013 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.2 -40.08 53.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.202 0.601 . . . . 0.0 111.14 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -37.59 67.2 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.951 177.724 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.78 77.24 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.244 0.618 . . . . 0.0 111.98 173.342 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -65.61 -59.33 4.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.532 0.733 . . . . 0.0 110.384 176.904 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.28 -49.52 69.42 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.544 1.138 . . . . 0.0 112.583 -177.949 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -64.18 -37.84 88.9 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.402 0.681 . . . . 0.0 111.73 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -62.17 -30.96 71.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.929 0.892 . . . . 0.0 110.692 175.891 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -85.92 -21.93 27.7 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.496 0.718 . . . . 0.0 110.629 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.6 -1.75 62.08 Favored Glycine 0 C--N 1.35 1.354 0 O-C-N 123.321 0.388 . . . . 0.0 112.722 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 26.8 mt -68.11 109.34 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-O 121.601 0.715 . . . . 0.0 110.144 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -58.08 141.34 50.38 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.772 169.02 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -141.12 149.86 42.11 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.146 0.43 . . . . 0.0 111.391 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -120.97 127.65 52.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.747 0.819 . . . . 0.0 109.494 172.955 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.402 HG22 HD12 ' A' ' 5' ' ' ILE . 35.1 t -102.51 134.83 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 123.761 0.825 . . . . 0.0 108.872 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.9 mt -130.71 121.04 49.42 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -178.704 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 75.1 mt . . . . . 0 CA--C 1.544 0.713 0 C-N-CA 123.744 0.817 . . . . 0.0 112.032 -175.217 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 120.651 0.263 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.42 137.46 37.89 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.479 0.711 . . . . 0.0 109.224 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -112.81 123.69 50.89 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 mp -105.93 123.31 60.41 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 N-CA-C 106.779 -1.564 . . . . 0.0 106.779 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -150.88 174.53 12.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.224 1.01 . . . . 0.0 108.354 -177.748 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -139.73 98.08 7.98 Favored Pre-proline 0 C--O 1.242 0.688 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo . . . . . 0 C--N 1.366 1.498 0 C-N-CA 122.707 2.271 . . . . 0.0 112.186 -175.823 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -85.96 132.57 34.05 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -176.477 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.1 t -102.12 138.44 26.36 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.489 HD22 HD23 ' A' ' 53' ' ' LEU . 9.1 tt -114.82 107.81 15.92 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 172.727 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -108.7 134.84 50.88 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 174.852 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.1 p90 . . . . . 0 N--CA 1.474 0.756 0 CA-C-N 118.546 0.612 . . . . 0.0 112.053 -176.439 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 120.687 0.28 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.5 ptpt -133.69 132.43 40.65 Favored 'General case' 0 C--N 1.352 0.681 0 CA-C-O 121.771 0.796 . . . . 0.0 110.826 174.764 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.489 HD23 HD22 ' A' ' 25' ' ' LEU . 2.0 mm? -115.83 148.41 39.95 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.8 p -114.86 130.93 56.98 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.67 -0.644 . . . . 0.0 109.677 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -130.84 146.48 52.29 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.469 1.507 . . . . 0.0 108.32 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -68.63 -27.16 65.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.797 0.439 . . . . 0.0 112.169 -175.908 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.4 p -134.3 159.28 41.48 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.629 0.771 . . . . 0.0 110.352 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -56.33 -46.29 79.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.65 1.18 . . . . 0.0 111.4 172.115 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -51.19 -45.42 61.81 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 124.909 1.381 . . . . 0.0 111.992 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -70.85 -29.14 65.18 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.609 0.764 . . . . 0.0 111.774 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.66 -44.42 28.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.033 0.533 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.49 -37.75 74.27 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.649 -177.301 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.35 -36.35 75.55 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.403 0.681 . . . . 0.0 112.302 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -62.66 -57.13 12.11 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.254 0.621 . . . . 0.0 109.905 177.883 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.58 -47.74 66.66 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.494 1.117 . . . . 0.0 111.777 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -60.06 -45.92 91.26 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.248 1.019 . . . . 0.0 112.004 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -60.54 -31.0 70.12 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.147 . . . . 0.0 111.172 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -87.84 -21.03 25.27 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.621 0.769 . . . . 0.0 111.059 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.52 -3.8 63.67 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-O 119.984 -0.342 . . . . 0.0 112.628 -174.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 48.1 mt -63.14 108.89 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 CA-C-O 121.048 0.452 . . . . 0.0 109.873 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -57.73 139.99 52.55 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.489 172.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.0 p90 -142.18 147.8 37.19 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.851 0.751 . . . . 0.0 112.102 -168.476 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -121.04 110.4 16.2 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 175.065 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.4 t -83.73 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.6 mt -121.65 129.17 75.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 125.931 1.692 . . . . 0.0 108.04 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 CA--C 1.541 0.633 0 O-C-N 123.321 0.388 . . . . 0.0 110.863 175.724 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 20.1 t . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.66 136.55 40.35 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.608 0.763 . . . . 0.0 109.712 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -108.84 120.1 41.49 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 107.197 -1.409 . . . . 0.0 107.197 175.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.447 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.2 mp -104.54 123.15 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 177.76 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -151.48 173.04 15.06 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -176.94 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 68.0 ttt180 -138.84 97.16 9.05 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.082 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 C--N 1.365 1.421 0 C-N-CA 122.285 1.99 . . . . 0.0 111.502 -175.119 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.451 HG23 HG22 ' A' ' 54' ' ' THR . 9.6 m . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.626 0.25 . . . . 0.0 110.938 . . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.6 m95 -88.88 132.75 34.54 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.068 0.947 . . . . 0.0 109.338 -172.849 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.7 t -101.44 138.84 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.511 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 53.8 tp -114.42 106.69 14.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 125.369 1.468 . . . . 0.0 107.17 176.279 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -115.46 132.38 56.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.5 p90 . . . . . 0 C--O 1.243 0.746 0 C-N-CA 123.357 0.663 . . . . 0.0 110.592 177.163 . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -138.79 138.69 37.82 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.515 176.669 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp -119.18 151.71 37.86 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.451 HG22 HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -122.88 128.45 50.36 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.644 0.657 . . . . 0.0 110.539 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -129.05 154.88 46.24 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.834 1.254 . . . . 0.0 108.999 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -67.8 -29.6 68.81 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.569 0.543 . . . . 0.0 111.874 -177.424 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 56.7 p -133.04 161.14 35.15 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 123.43 0.692 . . . . 0.0 111.079 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -54.63 -48.99 71.57 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.117 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -45.37 -46.16 12.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.08 1.752 . . . . 0.0 113.288 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -70.32 -33.82 71.96 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.11 0.564 . . . . 0.0 112.039 -178.476 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.511 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -80.42 -38.06 30.93 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.305 0.574 . . . . 0.0 110.753 -174.286 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -72.1 -40.25 68.31 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.387 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.52 70.94 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.254 0.622 . . . . 0.0 112.118 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -63.81 -57.1 10.94 Favored 'General case' 0 C--N 1.352 0.695 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.468 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.89 -46.46 67.98 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.494 1.118 . . . . 0.0 112.223 177.809 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -60.12 -47.69 84.87 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.41 1.084 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -57.84 -36.28 72.08 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.779 1.232 . . . . 0.0 111.253 177.768 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -80.96 -25.38 37.41 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.594 0.758 . . . . 0.0 111.011 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.29 -5.55 63.0 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.032 0.349 . . . . 0.0 112.499 -171.362 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.72 110.62 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.343 0 C-N-CA 123.399 0.68 . . . . 0.0 110.79 -177.193 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 2' ' ' SER . 1.6 pm0 -54.19 138.91 37.24 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 113.645 -1.616 . . . . 0.0 109.343 169.992 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -148.21 151.2 35.1 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.0 0.818 . . . . 0.0 112.087 -170.241 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.511 HH11 HG13 ' A' ' 75' ' ' ILE . 1.2 tmt_? -121.56 125.71 47.41 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.091 0.956 . . . . 0.0 108.651 171.58 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.447 HG12 ' HB ' ' A' ' 5' ' ' ILE . 33.9 m -93.49 137.88 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.68 0.792 . . . . 0.0 110.315 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.511 HG13 HH11 ' A' ' 73' ' ' ARG . 4.1 mp -121.1 137.32 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.576 1.15 . . . . 0.0 108.325 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 CA--C 1.547 0.854 0 C-N-CA 123.855 0.862 . . . . 0.0 111.469 -178.839 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.478 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -99.96 129.02 45.99 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.607 0.763 . . . . 0.0 109.973 -177.851 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 4' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -114.6 119.87 38.25 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.988 0.915 . . . . 0.0 108.587 179.103 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.496 HG13 HD13 ' A' ' 25' ' ' LEU . 3.6 mp -106.81 122.69 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -176.274 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -150.14 161.89 41.51 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.4 0.619 . . . . 0.0 111.73 -172.233 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -119.51 103.54 46.49 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.482 168.942 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo . . . . . 0 CA--C 1.55 1.281 0 C-N-CA 122.265 1.977 . . . . 0.0 112.015 -179.878 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.411 HG21 ' HB ' ' A' ' 54' ' ' THR . 14.7 p . . . . . 0 C--O 1.244 0.8 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -85.04 127.3 34.16 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -101.43 136.94 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.581 HD23 HD12 ' A' ' 53' ' ' LEU . 58.8 tp -118.26 104.12 10.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.986 1.315 . . . . 0.0 108.715 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.58 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 43.4 mt-10 -104.68 136.92 43.31 Favored 'General case' 0 C--O 1.212 -0.921 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.218 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 p90 . . . . . 0 N--CA 1.476 0.844 0 CA-C-N 118.499 0.591 . . . . 0.0 109.918 174.473 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.9 m . . . . . 0 N--CA 1.472 0.671 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.58 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -135.94 140.27 43.89 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.563 0.696 . . . . 0.0 112.034 -174.151 . . . . . . . . 3 3 . 1 . 007 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 25' ' ' LEU . 50.6 mt -116.81 156.01 27.98 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.609 1.564 . . . . 0.0 107.403 177.207 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.411 ' HB ' HG21 ' A' ' 22' ' ' VAL . 18.7 p -119.9 133.57 55.53 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.655 -0.653 . . . . 0.0 110.623 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.431 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 96.0 m-85 -135.54 147.67 48.85 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.886 1.275 . . . . 0.0 109.277 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -67.6 -24.62 65.51 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 123.601 0.563 . . . . 0.0 111.755 -174.409 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 76.1 p -134.44 163.13 30.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.398 0.679 . . . . 0.0 110.2 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -61.63 -39.5 91.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.471 0.708 . . . . 0.0 110.392 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -52.14 -44.62 64.65 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.747 1.279 . . . . 0.0 112.559 -176.263 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 51.4 mt-30 -70.97 -30.39 66.65 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.543 0.737 . . . . 0.0 111.976 -177.143 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.87 -38.61 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.306 0.643 . . . . 0.0 111.301 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -76.09 -39.02 56.27 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.82 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -30.68 71.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 111.695 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -64.42 -53.42 48.62 Favored 'General case' 0 C--N 1.354 0.803 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 174.899 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.43 -43.93 75.81 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.214 1.005 . . . . 0.0 111.724 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -64.56 -44.57 90.33 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.35 1.06 . . . . 0.0 111.663 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -64.39 -28.78 69.92 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.757 0.823 . . . . 0.0 110.659 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -89.18 -16.84 30.4 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.451 0.7 . . . . 0.0 111.072 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.23 -7.49 81.44 Favored Glycine 0 C--N 1.35 1.335 0 C-N-CA 123.261 0.458 . . . . 0.0 112.89 -176.523 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.2 mt -59.35 112.01 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 123.233 0.613 . . . . 0.0 110.458 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -55.13 135.83 48.9 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.646 173.437 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -141.22 144.9 34.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.492 1.042 . . . . 0.0 112.505 -170.348 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 18.7 tpp180 -116.92 138.11 51.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.52 1.528 . . . . 0.0 108.298 170.515 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.485 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -105.06 133.34 49.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-O 121.113 0.482 . . . . 0.0 110.328 174.997 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.3 mp -104.12 112.26 36.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.1 mt . . . . . 0 CA--C 1.543 0.694 0 C-N-CA 123.747 0.819 . . . . 0.0 111.328 -175.793 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.2 138.61 38.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -167.058 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -107.23 122.04 45.74 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 175.082 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.507 HG13 HD23 ' A' ' 25' ' ' LEU . 4.3 mp -103.44 122.95 56.64 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.178 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -150.15 178.15 9.25 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.426 ' HD2' ' NE1' ' A' ' 23' ' ' TRP . 15.6 ttt180 -136.89 97.14 11.27 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo . . . . . 0 C--N 1.366 1.492 0 C-N-CA 122.913 2.409 . . . . 0.0 113.211 -165.554 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.463 HG21 ' HB ' ' A' ' 54' ' ' THR . 14.1 p . . . . . 0 CA--C 1.544 0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.426 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 67.8 m95 -88.72 131.86 34.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.099 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.5 t -101.14 139.88 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.244 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.507 HD23 HG13 ' A' ' 5' ' ' ILE . 3.2 tm? -114.64 104.35 11.9 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 105.828 -1.915 . . . . 0.0 105.828 174.563 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -113.35 131.73 55.85 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.2 p90 . . . . . 0 N--CA 1.476 0.843 0 C-N-CA 123.597 0.759 . . . . 0.0 110.715 178.266 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 14.7 ptpt -144.0 139.01 28.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.588 0.708 . . . . 0.0 111.796 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.5 mt -118.47 157.79 26.58 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.469 1.507 . . . . 0.0 108.026 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.463 ' HB ' HG21 ' A' ' 22' ' ' VAL . 34.7 p -119.01 135.09 54.8 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.177 0.591 . . . . 0.0 109.956 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.54 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.9 m-85 -138.38 148.45 44.52 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.206 1.402 . . . . 0.0 109.787 -178.342 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -63.14 -32.98 74.49 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.353 0.661 . . . . 0.0 111.896 -174.631 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.9 p -134.65 164.12 28.22 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.658 0.783 . . . . 0.0 111.274 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.2 -46.1 86.42 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.137 173.96 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -48.42 -43.81 34.58 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 124.999 1.437 . . . . 0.0 112.811 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.54 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 26.9 mt-30 -70.12 -35.15 73.9 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.529 0.731 . . . . 0.0 111.774 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -76.84 -39.12 52.3 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.491 0.662 . . . . 0.0 110.653 -175.571 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -30.22 55.43 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.09 -36.0 76.42 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.296 0.639 . . . . 0.0 111.757 173.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -62.2 -58.44 7.76 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.58 -48.09 63.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.948 1.299 . . . . 0.0 112.423 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -61.06 -46.1 92.05 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.318 1.047 . . . . 0.0 111.392 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -59.56 -34.85 73.21 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.536 1.135 . . . . 0.0 111.242 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -87.66 -20.49 26.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.84 0.856 . . . . 0.0 111.587 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.57 -1.93 69.7 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 123.172 0.295 . . . . 0.0 113.143 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.8 mt -59.07 112.24 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.525 0.73 . . . . 0.0 110.939 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -58.0 138.1 56.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.281 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -146.71 148.84 32.41 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 118.719 0.69 . . . . 0.0 112.658 -172.964 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -114.18 122.96 48.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.007 1.323 . . . . 0.0 108.978 170.182 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.421 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -91.48 137.06 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.178 0.591 . . . . 0.0 110.007 173.283 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -122.15 137.18 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.776 1.63 . . . . 0.0 107.817 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.8 mt . . . . . 0 CA--C 1.547 0.828 0 C-N-CA 122.756 0.423 . . . . 0.0 110.242 175.871 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.0 p . . . . . 0 N--CA 1.47 0.546 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.419 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -99.99 146.25 26.93 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -110.09 124.93 52.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.586 HG12 HD23 ' A' ' 25' ' ' LEU . 71.9 mt -98.41 129.76 48.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.686 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 173.235 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -152.15 -179.71 7.76 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.824 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 22' ' ' VAL . 46.7 ttt180 -144.28 95.59 5.5 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 176.069 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo . . . . . 0 C--N 1.366 1.477 0 C-N-CA 123.082 2.521 . . . . 0.0 112.842 -163.735 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.401 ' O ' ' HG3' ' A' ' 7' ' ' ARG . 31.5 m . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 110.537 -0.171 . . . . 0.0 110.537 . . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -86.62 136.7 32.95 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.448 0.699 . . . . 0.0 109.153 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.7 t -101.61 139.42 22.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.912 173.185 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.586 HD23 HG12 ' A' ' 5' ' ' ILE . 2.8 tm? -117.81 104.55 11.07 Favored 'General case' 0 C--N 1.343 0.326 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -107.47 134.32 50.68 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.628 -1.169 . . . . 0.0 107.886 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.4 p90 . . . . . 0 N--CA 1.471 0.58 0 C-N-CA 123.651 0.78 . . . . 0.0 109.555 176.919 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 33.3 m . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.6 pttt -144.87 155.88 43.7 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 121.597 0.713 . . . . 0.0 112.73 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.446 HD12 HD12 ' A' ' 25' ' ' LEU . 43.0 mt -125.39 160.4 29.48 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.74 1.616 . . . . 0.0 108.342 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 15.5 p -118.84 129.41 55.2 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.552 0.741 . . . . 0.0 109.795 172.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.15 147.31 50.55 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.79 1.636 . . . . 0.0 108.169 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -67.28 -31.36 71.62 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.615 0.766 . . . . 0.0 111.227 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 55.2 p -132.41 160.45 36.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.077 0.951 . . . . 0.0 110.112 -177.464 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -60.45 -40.87 92.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.375 0.67 . . . . 0.0 110.481 171.544 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -47.33 -47.21 25.82 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 124.497 1.123 . . . . 0.0 112.717 177.929 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -69.65 -31.03 68.87 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 122.967 0.507 . . . . 0.0 111.761 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.34 -42.99 34.53 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.561 0.744 . . . . 0.0 111.599 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -69.86 -42.68 73.18 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.894 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.65 -32.62 71.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.23 0.612 . . . . 0.0 111.474 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -64.68 -60.01 3.6 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 123.228 0.611 . . . . 0.0 109.533 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.94 -50.22 69.4 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.68 1.192 . . . . 0.0 112.332 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -59.57 -42.24 92.01 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.976 0.91 . . . . 0.0 111.566 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -62.22 -30.57 71.18 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.646 1.178 . . . . 0.0 110.931 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -87.88 -19.53 27.24 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.274 0.63 . . . . 0.0 111.058 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.04 -2.89 66.47 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 112.845 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 45.6 mt -67.14 108.56 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.172 0 CA-C-O 121.274 0.559 . . . . 0.0 110.537 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.44 140.77 57.08 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.845 171.524 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.419 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 34.5 p90 -142.31 151.63 42.16 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 118.633 0.651 . . . . 0.0 112.032 -169.394 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -120.42 115.49 23.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.247 1.019 . . . . 0.0 108.441 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -81.83 133.45 29.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.069 0.547 . . . . 0.0 111.1 177.723 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.02 136.9 51.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 125.721 1.608 . . . . 0.0 107.477 174.136 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.5 mt . . . . . 0 CA--C 1.546 0.801 0 C-N-CA 123.214 0.606 . . . . 0.0 110.875 179.026 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 2' ' ' SER . . . . . 0.422 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 14.6 t . . . . . 0 N--CA 1.482 1.129 0 CA-C-O 120.856 0.36 . . . . 0.0 111.257 . . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.21 137.33 38.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.256 1.022 . . . . 0.0 110.394 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.55 119.98 41.09 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 108.042 175.113 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.0 mp -105.56 123.5 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 175.553 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.9 p90 -156.07 172.7 17.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.652 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -136.19 96.97 12.33 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.088 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo . . . . . 0 C--N 1.36 1.159 0 C-N-CA 122.186 1.924 . . . . 0.0 112.217 -173.047 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -75.07 123.06 24.52 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 67.8 t -101.48 138.37 25.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 53' ' ' LEU . 52.4 tp -116.06 105.31 12.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 173.572 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.556 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 16.1 mt-10 -106.58 137.85 43.84 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 172.12 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.3 p90 . . . . . 0 CA--C 1.502 -0.875 0 CA-C-N 117.571 0.169 . . . . 0.0 110.779 177.736 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m . . . . . 0 C--O 1.241 0.652 0 CA-C-O 121.056 0.455 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.556 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 3.6 ptpp? -133.21 135.77 45.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.792 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.522 HD12 HD23 ' A' ' 25' ' ' LEU . 42.4 mt -117.47 142.91 46.59 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -114.68 128.95 56.59 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -134.56 156.64 48.31 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.254 1.022 . . . . 0.0 110.133 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -65.14 -31.3 72.42 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.001 0.813 . . . . 0.0 111.466 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 49.6 p -135.62 164.06 28.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.412 0.685 . . . . 0.0 110.965 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.89 -41.73 87.85 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.75 169.017 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -49.83 -45.74 50.54 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.922 1.389 . . . . 0.0 111.474 -174.343 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -72.19 -30.03 64.56 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.046 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.511 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -79.48 -40.59 29.4 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.227 0.611 . . . . 0.0 111.067 -176.912 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -70.78 -39.58 73.1 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.936 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.22 -36.77 66.32 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.739 0.816 . . . . 0.0 112.5 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -66.59 -55.91 13.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.019 0.528 . . . . 0.0 110.299 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.79 -47.09 64.36 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.437 1.095 . . . . 0.0 112.056 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -59.45 -45.24 92.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.091 0.956 . . . . 0.0 111.647 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.5 ttt180 -54.09 -39.39 66.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.737 1.215 . . . . 0.0 111.309 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.98 -27.0 36.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.434 0.694 . . . . 0.0 111.432 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 98.3 1.51 58.03 Favored Glycine 0 C--N 1.349 1.263 0 O-C-N 123.216 0.323 . . . . 0.0 112.592 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.9 mt -69.35 107.25 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 CA-C-O 121.403 0.621 . . . . 0.0 110.201 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.4 pt-20 -54.04 143.94 20.72 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.018 170.826 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -147.36 149.25 32.43 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.501 1.046 . . . . 0.0 113.026 -168.538 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -110.76 125.94 54.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.484 1.114 . . . . 0.0 109.928 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 92.4 t -89.89 118.59 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 173.777 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 77.1 mt -122.6 117.34 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.03 1.332 . . . . 0.0 108.444 -174.45 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 80.2 mt . . . . . 0 CA--C 1.548 0.9 0 C-N-CA 124.045 0.938 . . . . 0.0 112.239 -174.273 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.8 m . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.5 155.38 24.24 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 113.132 0.789 . . . . 0.0 113.132 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -113.05 123.73 50.97 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.062 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.444 HG12 ' HG ' ' A' ' 25' ' ' LEU . 89.9 mt -105.22 127.36 59.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 174.926 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -148.69 176.5 10.31 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 123.369 0.668 . . . . 0.0 109.434 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -140.72 95.72 7.77 Favored Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 173.806 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo . . . . . 0 C--N 1.361 1.206 0 C-N-CA 122.968 2.446 . . . . 0.0 114.607 -163.924 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.5 m . . . . . 0 N--CA 1.476 0.874 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.4 m95 -86.64 125.93 34.17 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.3 t -100.52 136.23 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.444 ' HG ' HG12 ' A' ' 5' ' ' ILE . 5.5 tt -116.07 108.37 16.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 178.205 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -107.05 135.0 49.35 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 175.56 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.0 p90 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -175.025 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.4 p . . . . . 0 CA--C 1.552 1.04 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -135.4 140.79 45.23 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.316 0.579 . . . . 0.0 111.833 -173.993 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.4 mp -120.47 153.12 37.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.988 1.315 . . . . 0.0 107.887 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.1 p -118.11 133.52 55.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.866 0.466 . . . . 0.0 110.634 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -133.84 147.18 51.17 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.108 1.363 . . . . 0.0 108.512 -177.5 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -71.07 -24.53 62.34 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -172.764 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 81.1 p -136.78 163.2 31.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.647 0.779 . . . . 0.0 109.736 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -64.51 -36.28 83.7 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.757 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -51.0 -48.93 61.25 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.912 0.885 . . . . 0.0 111.613 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -69.29 -29.36 67.22 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.319 -176.785 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.4 -41.51 32.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.17 0.588 . . . . 0.0 110.994 177.424 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.516 ' O ' ' HG3' ' A' ' 66' ' ' GLN . 13.0 pt-20 -77.43 -44.47 28.98 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.426 -169.991 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.14 69.02 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.414 1.086 . . . . 0.0 112.16 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -64.07 -54.7 29.99 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 172.319 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.5 -44.87 81.11 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.473 1.109 . . . . 0.0 111.944 178.774 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' GLN . . . . . 0.516 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 73.1 mt-30 -60.74 -44.28 96.87 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.105 0.962 . . . . 0.0 110.636 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -62.26 -31.07 71.59 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.005 1.322 . . . . 0.0 111.01 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -87.19 -22.16 25.46 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.051 0.94 . . . . 0.0 110.745 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.29 -1.31 72.96 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.704 -172.382 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.28 109.86 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-O 121.501 0.667 . . . . 0.0 110.357 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.17 133.94 53.87 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 113.793 -1.549 . . . . 0.0 108.102 171.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 55.7 p90 -140.38 152.68 45.95 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.611 -0.681 . . . . 0.0 110.927 -171.333 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 tpt85 -118.16 116.46 26.87 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 171.297 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.9 m -82.28 132.35 31.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-O 121.457 0.646 . . . . 0.0 110.69 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 mp -114.4 136.15 51.91 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 CA--C 1.545 0.776 0 C-N-CA 123.339 0.656 . . . . 0.0 111.863 -178.052 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.441 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -100.93 136.95 39.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.946 0.898 . . . . 0.0 109.738 -177.461 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -115.28 125.29 53.12 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 mp -105.37 121.82 57.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -147.62 172.3 14.25 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.393 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.422 ' HD2' ' NE1' ' A' ' 23' ' ' TRP . 38.7 ttt-85 -139.4 94.29 9.6 Favored Pre-proline 0 C--O 1.24 0.567 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 177.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo . . . . . 0 C--N 1.37 1.707 0 C-N-CA 122.866 2.378 . . . . 0.0 113.537 -168.987 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.422 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 77.1 m95 -77.5 116.05 17.76 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 177.178 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.509 HG22 HG22 ' A' ' 54' ' ' THR . 40.5 t -100.48 139.59 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.441 HD11 ' HB1' ' A' ' 3' ' ' ALA . 47.8 tp -116.24 106.08 13.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.246 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -114.94 133.14 56.26 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.4 p90 . . . . . 0 CA--C 1.505 -0.752 0 C-N-CA 123.807 0.843 . . . . 0.0 109.443 179.285 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.9 m . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -143.82 142.22 30.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.803 0.811 . . . . 0.0 112.28 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.31 159.96 23.96 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.324 1.85 . . . . 0.0 107.281 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.509 HG22 HG22 ' A' ' 24' ' ' VAL . 25.1 p -125.76 131.38 52.52 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.718 0.407 . . . . 0.0 110.743 177.349 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -129.44 153.61 47.77 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.176 1.391 . . . . 0.0 109.137 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -70.62 -25.56 63.08 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.008 0.523 . . . . 0.0 112.097 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 71.3 p -134.15 162.56 31.79 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.986 0.422 . . . . 0.0 111.033 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -58.48 -44.56 89.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.863 170.293 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -54.22 -43.64 70.98 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.652 1.22 . . . . 0.0 112.207 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -71.07 -30.58 66.75 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.083 0.553 . . . . 0.0 111.813 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -80.41 -38.54 30.04 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.299 0.571 . . . . 0.0 110.859 -177.034 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -76.34 -37.36 57.43 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.099 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.06 73.34 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.77 0.828 . . . . 0.0 111.722 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -65.8 -51.3 60.18 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.239 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.37 74.01 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.383 1.073 . . . . 0.0 111.515 175.302 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -63.65 -42.94 98.06 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.389 1.076 . . . . 0.0 111.63 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -55.77 -36.83 67.77 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.899 1.279 . . . . 0.0 110.735 175.554 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.425 ' HB2' HG13 ' A' ' 70' ' ' ILE . 35.0 mmtp -88.62 -19.21 26.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.458 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.27 -3.33 66.33 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-O 119.967 -0.352 . . . . 0.0 112.992 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.425 HG13 ' HB2' ' A' ' 68' ' ' LYS . 22.1 mt -61.61 109.58 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 123.05 0.54 . . . . 0.0 109.569 -178.936 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.05 139.06 42.55 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 113.544 -1.662 . . . . 0.0 108.79 171.687 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -140.52 147.4 39.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.414 1.006 . . . . 0.0 112.005 -169.346 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -122.34 136.67 54.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.841 1.257 . . . . 0.0 108.439 169.101 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 m -105.69 138.23 31.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.131 0.572 . . . . 0.0 110.246 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.87 136.39 57.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.01 1.724 . . . . 0.0 107.029 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 85.6 mt . . . . . 0 CA--C 1.549 0.934 0 C-N-CA 123.384 0.674 . . . . 0.0 111.345 179.91 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.4 p . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.448 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -99.69 135.65 40.79 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.529 0.732 . . . . 0.0 109.948 -176.544 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -108.19 126.81 53.22 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.511 ' HB ' HG12 ' A' ' 74' ' ' VAL . 57.0 mt -107.32 120.98 59.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.625 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 173.972 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -144.86 173.1 12.15 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -141.38 94.38 7.62 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.371 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo . . . . . 0 C--N 1.364 1.369 0 C-N-CA 123.365 2.71 . . . . 0.0 113.021 -169.964 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.403 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 20.9 m . . . . . 0 N--CA 1.481 1.102 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -85.15 121.71 28.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -177.433 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.507 HG22 HG22 ' A' ' 54' ' ' THR . 53.1 t -100.21 136.53 31.18 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.448 HD11 ' HB1' ' A' ' 3' ' ' ALA . 56.2 tp -116.77 106.28 13.31 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.878 1.271 . . . . 0.0 108.336 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -112.38 133.7 54.33 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.4 p90 . . . . . 0 N--CA 1.474 0.739 0 CA-C-N 118.372 0.533 . . . . 0.0 110.87 -177.34 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.471 0.607 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -137.55 147.69 45.34 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.927 0.87 . . . . 0.0 112.309 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.94 156.69 29.11 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 113.721 -1.581 . . . . 0.0 107.136 176.591 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.507 HG22 HG22 ' A' ' 24' ' ' VAL . 12.2 p -122.76 128.6 50.69 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.419 0.554 . . . . 0.0 110.372 176.31 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.403 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 97.9 m-85 -128.62 152.15 48.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.379 1.472 . . . . 0.0 108.534 -178.248 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -65.96 -33.63 76.27 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.888 0.375 . . . . 0.0 111.302 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 65.1 p -134.33 159.32 41.37 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.52 0.728 . . . . 0.0 110.694 -173.686 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -58.45 -44.84 89.35 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.54 1.136 . . . . 0.0 111.419 174.243 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -50.36 -43.11 54.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.322 . . . . 0.0 112.798 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -70.99 -31.68 68.29 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.013 0.525 . . . . 0.0 111.964 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.53 -40.31 57.16 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.78 0.432 . . . . 0.0 111.088 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -72.45 -33.87 67.35 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.773 177.632 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.2 -41.25 75.29 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.08 0.552 . . . . 0.0 111.427 173.763 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -67.08 -58.79 4.22 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 123.314 0.645 . . . . 0.0 110.387 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -50.85 -51.48 50.95 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.79 1.236 . . . . 0.0 112.744 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -63.6 -40.02 95.86 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.698 0.799 . . . . 0.0 111.816 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -54.45 -37.15 64.85 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.615 1.166 . . . . 0.0 110.855 174.289 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.548 ' HB2' HG13 ' A' ' 70' ' ' ILE . 33.0 mmtp -90.43 -20.06 23.19 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.497 0.719 . . . . 0.0 111.686 -178.441 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.57 1.86 60.28 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-O 119.891 -0.394 . . . . 0.0 113.14 -176.406 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.548 HG13 ' HB2' ' A' ' 68' ' ' LYS . 10.7 mt -64.25 108.71 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-O 120.956 0.408 . . . . 0.0 110.439 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -56.43 139.2 49.78 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.152 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -148.14 153.09 38.37 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.794 0.724 . . . . 0.0 111.179 -170.408 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' ARG . . . . . 0.43 ' NH1' HG13 ' A' ' 75' ' ' ILE . 6.2 tmm_? -133.92 146.81 50.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 169.539 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.511 HG12 ' HB ' ' A' ' 5' ' ' ILE . 19.8 m -106.36 140.91 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.746 0.784 . . . . 0.0 111.747 -173.834 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.43 HG13 ' NH1' ' A' ' 73' ' ' ARG . 3.3 mp -109.35 141.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 125.803 1.641 . . . . 0.0 107.088 173.517 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.6 mt . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 122.761 0.424 . . . . 0.0 111.531 179.171 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 p . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.63 137.12 39.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.909 0.484 . . . . 0.0 111.189 -166.112 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.85 132.11 54.45 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.827 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 58' ' ' GLN . 40.2 mt -112.57 123.98 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.667 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.45 175.29 12.0 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -136.74 97.17 11.45 Favored Pre-proline 0 N--CA 1.479 0.992 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo . . . . . 0 C--N 1.371 1.717 0 C-N-CA 123.253 2.635 . . . . 0.0 112.638 -170.745 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.445 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 16.8 m . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 . . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -86.94 130.32 34.51 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -177.11 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.1 t -101.29 137.54 28.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 54.2 tp -115.27 105.09 12.47 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 177.377 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -118.58 130.17 55.74 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.441 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.2 p90 . . . . . 0 N--CA 1.475 0.786 0 CA-C-N 118.401 0.546 . . . . 0.0 111.561 -173.875 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 C--O 1.241 0.625 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.61 150.48 37.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.336 1.065 . . . . 0.0 113.361 -173.056 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -121.68 159.15 27.14 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 113.532 -1.667 . . . . 0.0 107.599 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 p -122.28 129.87 52.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.081 0.953 . . . . 0.0 110.309 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.462 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 94.9 m-85 -130.54 148.93 52.4 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.268 1.427 . . . . 0.0 108.171 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.99 -29.65 70.07 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 120.906 0.384 . . . . 0.0 110.477 -176.066 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.8 p -133.07 159.66 39.44 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.2 1.0 . . . . 0.0 110.134 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.472 ' HG3' HG21 ' A' ' 5' ' ' ILE . 41.0 tt0 -59.99 -41.17 91.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.7 0.8 . . . . 0.0 110.864 171.871 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -50.48 -45.57 56.37 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 124.559 1.162 . . . . 0.0 112.201 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.462 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 53.5 mt-30 -67.32 -32.54 73.57 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.178 0.591 . . . . 0.0 111.385 -178.571 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.18 -42.95 54.73 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.058 0.543 . . . . 0.0 111.459 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -75.08 -39.22 60.94 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.844 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.29 71.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.518 0.727 . . . . 0.0 111.661 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 64' ' ' TYR . . . . . 0.507 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 14.9 t80 -66.91 -56.64 9.39 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.942 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.83 -45.66 70.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.086 0.954 . . . . 0.0 112.529 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -62.03 -43.93 97.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.487 1.115 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -57.23 -34.52 68.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.703 1.201 . . . . 0.0 111.646 176.972 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.63 ' HB2' HG13 ' A' ' 70' ' ' ILE . 11.7 mmmm -92.22 -16.88 25.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.13 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 88.48 1.5 80.85 Favored Glycine 0 C--N 1.35 1.35 0 O-C-N 123.616 0.573 . . . . 0.0 112.849 -173.533 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.63 HG13 ' HB2' ' A' ' 68' ' ' LYS . 73.0 mt -57.95 114.94 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.259 0.623 . . . . 0.0 110.988 -179.247 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -57.61 131.2 49.51 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 113.942 -1.481 . . . . 0.0 108.543 169.692 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.7 p90 -144.01 147.97 34.61 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-O 121.272 0.558 . . . . 0.0 111.43 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -117.6 123.06 45.26 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.343 172.225 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.9 t -80.19 124.2 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 170.309 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -107.87 120.44 59.23 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 169.417 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.3 mt . . . . . 0 CA--C 1.544 0.748 0 O-C-N 123.185 0.303 . . . . 0.0 110.28 176.662 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 m . . . . . 0 N--CA 1.473 0.69 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.456 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -100.89 123.79 45.61 Favored 'General case' 0 C--O 1.218 -0.589 0 C-N-CA 123.146 0.578 . . . . 0.0 109.899 -172.069 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -107.18 119.26 38.91 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 91.5 mt -105.09 121.19 56.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.439 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.7 p90 -152.15 177.49 10.47 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.7 ttt180 -143.52 97.5 5.52 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.623 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo . . . . . 0 C--N 1.371 1.745 0 C-N-CA 122.675 2.25 . . . . 0.0 112.085 -174.913 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 C--O 1.246 0.914 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -85.3 133.39 34.15 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.3 t -102.31 137.24 30.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.201 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 2.8 tt -115.72 106.61 14.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 175.643 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -116.89 131.17 57.02 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 -177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.456 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 43.1 p90 . . . . . 0 C--O 1.242 0.698 0 C-N-CA 123.334 0.654 . . . . 0.0 110.522 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 . . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 14.5 ptpt -137.75 133.11 33.72 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.592 0.711 . . . . 0.0 112.233 -175.833 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.4 mp -119.45 151.09 39.13 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.191 1.396 . . . . 0.0 107.652 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.2 p -118.26 132.54 56.3 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 118.564 0.62 . . . . 0.0 111.243 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -132.7 149.53 52.28 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.247 1.419 . . . . 0.0 108.938 -177.787 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -68.91 -28.19 66.45 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.936 0.494 . . . . 0.0 111.901 -176.138 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.0 p -134.64 162.14 33.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.442 0.697 . . . . 0.0 110.909 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.74 -43.0 98.46 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.622 0.769 . . . . 0.0 111.011 171.857 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -57.1 -37.5 72.03 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.225 0.953 . . . . 0.0 111.779 -175.562 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -72.91 -32.81 65.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.999 0.52 . . . . 0.0 111.442 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.73 -39.06 57.88 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 -177.301 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.11 -32.29 63.15 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.952 176.915 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.67 -37.91 66.33 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.359 0.663 . . . . 0.0 111.693 174.175 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -65.34 -59.78 3.67 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.643 0.777 . . . . 0.0 110.416 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.88 70.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.394 1.077 . . . . 0.0 112.767 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -63.01 -39.71 95.56 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.162 0.985 . . . . 0.0 111.287 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -53.82 -38.22 64.38 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.316 1.046 . . . . 0.0 111.322 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' LYS . . . . . 0.461 ' HB2' HG13 ' A' ' 70' ' ' ILE . 79.7 mttt -93.27 -18.03 22.94 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.921 -176.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.69 6.76 76.19 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.195 -172.635 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ILE . . . . . 0.461 HG13 ' HB2' ' A' ' 68' ' ' LYS . 67.7 mt -60.5 113.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -56.62 129.97 43.26 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.111 -1.858 . . . . 0.0 108.666 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -141.17 140.23 34.0 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.692 -0.63 . . . . 0.0 111.746 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.2 tpp85 -104.74 122.99 46.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.692 1.197 . . . . 0.0 108.937 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.1 t -85.12 125.88 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.439 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.7 mp -108.41 125.35 65.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 C-N-CA 125.397 1.479 . . . . 0.0 107.107 170.205 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.7 mt . . . . . 0 CA--C 1.545 0.772 0 C-N-CA 122.288 0.235 . . . . 0.0 111.092 179.386 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.2 p . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.469 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -98.02 145.07 26.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.055 -172.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -113.84 125.28 53.9 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 168.122 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.519 ' HB ' HG12 ' A' ' 74' ' ' VAL . 91.6 mt -107.07 121.49 59.98 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.452 ' HA ' ' O ' ' A' ' 75' ' ' ILE . 30.5 p90 -149.1 174.91 11.82 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -126.26 99.95 30.27 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 175.535 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 72.3 Cg_endo . . . . . 0 C--N 1.368 1.578 0 C-N-CA 123.022 2.481 . . . . 0.0 112.865 -172.501 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.42 ' O ' ' HD2' ' A' ' 8' ' ' PRO . 27.0 m . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 . . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -87.96 125.89 34.76 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 118.819 0.736 . . . . 0.0 109.448 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 76.1 t -101.39 138.97 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.412 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 9.4 tt -115.22 107.21 14.99 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -116.37 130.4 56.75 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 p90 . . . . . 0 CA--C 1.509 -0.623 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 -175.955 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.5 t . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 13.2 ptmm? -131.88 136.82 47.72 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.223 171.511 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.3 mp -120.12 144.63 47.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.354 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 19.2 p -111.8 128.86 56.24 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.085 0.554 . . . . 0.0 109.806 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -125.3 156.56 38.45 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 125.05 1.34 . . . . 0.0 108.943 -178.306 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.36 -42.0 97.99 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.246 1.018 . . . . 0.0 111.696 177.108 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.0 p -136.5 168.11 20.1 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 124.013 0.925 . . . . 0.0 110.014 -173.958 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -63.33 -37.38 87.04 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.484 173.701 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -58.55 -41.24 85.15 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 124.148 0.905 . . . . 0.0 111.815 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -70.36 -29.51 66.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.978 0.511 . . . . 0.0 111.817 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.72 -41.22 38.56 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.088 0.555 . . . . 0.0 110.747 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.52 -38.66 65.25 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.648 -177.467 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.78 -36.12 73.91 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 0.0 112.02 172.205 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -64.61 -58.26 6.82 Favored 'General case' 0 C--N 1.349 0.548 0 O-C-N 123.68 0.612 . . . . 0.0 110.011 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.55 -50.06 66.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.607 1.163 . . . . 0.0 112.382 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -60.59 -42.33 96.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.672 0.789 . . . . 0.0 111.163 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -61.93 -30.34 70.84 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.773 1.229 . . . . 0.0 111.152 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.61 -14.29 26.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.291 0.636 . . . . 0.0 111.274 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.39 2.03 83.13 Favored Glycine 0 C--N 1.351 1.374 0 O-C-N 123.15 0.281 . . . . 0.0 113.018 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.1 mt -62.23 111.91 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 CA-C-O 121.522 0.677 . . . . 0.0 111.121 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -61.23 133.31 55.78 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 113.434 -1.712 . . . . 0.0 108.528 169.895 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 72' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 53.7 p90 -138.77 143.59 39.03 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.055 0.843 . . . . 0.0 112.652 -171.927 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -110.19 110.57 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.912 1.285 . . . . 0.0 108.567 173.744 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.519 HG12 ' HB ' ' A' ' 5' ' ' ILE . 27.3 m -83.88 128.94 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' A' ' 6' ' ' TYR . 4.2 mp -119.55 126.37 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 172.739 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.3 mt . . . . . 0 CA--C 1.546 0.811 0 CA-C-O 119.298 -0.382 . . . . 0.0 110.247 177.984 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 p . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.83 139.24 36.8 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.328 0.651 . . . . 0.0 110.111 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -107.46 127.32 53.5 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.451 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.433 HG21 ' HG3' ' A' ' 58' ' ' GLN . 61.1 mt -107.09 122.94 61.87 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -147.19 176.58 9.86 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.6 ttt180 -141.52 96.02 7.05 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 175.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo . . . . . 0 C--N 1.365 1.44 0 C-N-CA 122.842 2.361 . . . . 0.0 112.754 -170.66 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 22' ' ' VAL . . . . . 0.446 HG21 ' HB ' ' A' ' 54' ' ' THR . 3.6 m . . . . . 0 C--O 1.244 0.782 0 CA-C-O 121.139 0.495 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -84.06 122.21 28.48 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 24' ' ' VAL . . . . . 0.5 HG22 HG22 ' A' ' 54' ' ' THR . 56.0 t -100.93 138.72 24.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.53 -177.088 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -117.43 105.06 11.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -117.11 130.18 56.46 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.3 p90 . . . . . 0 CA--C 1.51 -0.577 0 C-N-CA 123.105 0.562 . . . . 0.0 110.224 -177.28 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 120.963 0.411 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -146.17 142.84 28.85 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.164 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp -116.77 158.58 23.66 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.819 1.648 . . . . 0.0 108.106 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' THR . . . . . 0.5 HG22 HG22 ' A' ' 24' ' ' VAL . 17.0 p -122.84 133.87 54.42 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.656 0.782 . . . . 0.0 110.973 175.492 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' PHE . . . . . 0.401 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 98.8 m-85 -135.15 153.06 52.11 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.277 1.031 . . . . 0.0 109.897 -178.679 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -62.85 -32.42 73.64 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.26 0.624 . . . . 0.0 111.356 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 34.6 p -135.5 162.11 33.6 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.734 0.814 . . . . 0.0 111.127 -174.984 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' GLN . . . . . 0.433 ' HG3' HG21 ' A' ' 5' ' ' ILE . 41.6 tt0 -58.43 -41.9 86.09 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.705 170.667 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -49.36 -47.7 47.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.137 1.375 . . . . 0.0 112.563 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -69.32 -30.73 68.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.458 0.703 . . . . 0.0 111.7 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.6 -42.51 51.73 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.893 0.477 . . . . 0.0 111.139 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -72.18 -39.27 68.78 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.455 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.37 74.96 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 122.775 0.43 . . . . 0.0 111.956 176.247 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -66.13 -56.58 10.73 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.617 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.26 -48.71 68.03 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.468 1.107 . . . . 0.0 111.903 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -64.66 -40.42 95.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.821 0.848 . . . . 0.0 111.514 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -56.09 -35.51 67.11 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.928 1.291 . . . . 0.0 111.081 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -85.75 -23.11 27.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.789 0.836 . . . . 0.0 110.844 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.56 -0.75 65.7 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-O 120.089 -0.284 . . . . 0.0 112.415 -172.787 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 50.9 mt -65.44 108.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.09 139.75 40.45 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.173 -1.831 . . . . 0.0 108.74 169.001 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -136.58 145.59 45.13 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 118.866 0.757 . . . . 0.0 111.657 -171.963 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -118.21 130.0 55.82 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.703 1.201 . . . . 0.0 108.438 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 48.6 t -102.43 132.52 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 121.81 67.81 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.9 mt . . . . . 0 CA--C 1.545 0.761 0 C-N-CA 122.777 0.431 . . . . 0.0 111.265 -179.592 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.85 127.62 44.83 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -169.853 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -109.5 122.1 46.66 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.483 HG13 HD23 ' A' ' 25' ' ' LEU . 3.6 mp -103.6 119.79 52.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 6' ' ' TYR . . . . . 0.427 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 42.8 p90 -143.84 176.45 9.24 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 7' ' ' ARG . . . . . 0.431 ' HD2' ' NE1' ' A' ' 23' ' ' TRP . 78.2 ttt180 -142.68 100.81 5.53 Favored Pre-proline 0 C--N 1.314 -0.954 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 C--N 1.368 1.568 0 C-N-CA 122.089 1.859 . . . . 0.0 110.625 -177.193 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.245 0.864 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 23' ' ' TRP . . . . . 0.431 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 66.4 m95 -90.35 131.83 35.92 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.856 0.862 . . . . 0.0 109.039 -176.742 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -100.08 139.3 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.257 177.521 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 53' ' ' LEU . 3.4 tm? -111.34 105.2 13.78 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 175.001 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLU . . . . . 0.654 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 1.8 tm-20 -116.25 124.44 50.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 -174.602 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.6 p90 . . . . . 0 N--CA 1.472 0.66 0 CA-C-N 119.317 0.962 . . . . 0.0 111.667 -174.835 . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 32.1 m . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 120.941 0.4 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.654 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 4.5 ptpp? -133.72 142.7 48.08 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.234 1.016 . . . . 0.0 112.356 -171.946 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 53' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 25' ' ' LEU . 48.9 mt -118.56 154.0 33.31 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.944 1.698 . . . . 0.0 107.213 177.404 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 p -121.36 130.91 53.88 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.06 0.845 . . . . 0.0 110.134 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -129.1 153.49 47.61 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.836 1.655 . . . . 0.0 108.549 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -67.0 -32.9 74.45 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.789 0.436 . . . . 0.0 111.835 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.5 p -134.69 160.61 37.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.415 0.686 . . . . 0.0 111.226 -175.195 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -58.84 -45.53 89.84 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.224 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -50.42 -42.43 53.87 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.635 1.174 . . . . 0.0 112.831 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -71.26 -30.89 66.85 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.173 0.589 . . . . 0.0 112.17 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.41 -39.79 24.41 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.413 0.685 . . . . 0.0 111.188 -178.239 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -76.37 -39.87 52.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 114.636 -1.165 . . . . 0.0 111.229 -178.04 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.91 -25.88 65.71 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.423 0.689 . . . . 0.0 111.599 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -65.36 -52.44 53.68 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.05 -46.47 75.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.089 0.956 . . . . 0.0 111.415 176.297 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -58.73 -47.44 84.59 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.424 1.09 . . . . 0.0 111.222 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.0 ttm-85 -59.46 -32.46 70.26 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.136 1.375 . . . . 0.0 111.576 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -94.54 -12.2 28.04 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.422 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.97 -4.97 81.94 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-O 119.921 -0.377 . . . . 0.0 112.732 -178.187 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.44 113.65 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.947 0 C-N-CA 123.656 0.782 . . . . 0.0 110.883 -177.06 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -55.82 134.17 51.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 113.433 -1.712 . . . . 0.0 108.648 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -143.06 149.8 38.69 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 118.237 0.471 . . . . 0.0 110.81 -174.325 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -133.51 141.17 47.63 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 171.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.474 HG12 ' HB ' ' A' ' 5' ' ' ILE . 18.0 m -103.86 139.97 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-O 121.131 0.491 . . . . 0.0 111.18 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' ILE . . . . . 0.427 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.4 mp -109.29 121.94 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 171.786 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 mt . . . . . 0 CA--C 1.55 0.979 0 C-N-CA 122.77 0.428 . . . . 0.0 111.169 -179.232 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 108.193 -1.039 . . . . 0.0 108.193 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.94 156.15 24.44 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -173.718 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -113.0 126.36 55.42 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.924 1.29 . . . . 0.0 109.099 164.705 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.1 mt -103.21 129.6 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 171.582 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -154.03 -179.14 7.6 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 123.857 0.863 . . . . 0.0 109.552 176.113 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -141.39 99.36 6.43 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 106.957 -1.497 . . . . 0.0 106.957 174.254 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 C--N 1.368 1.572 0 C-N-CA 122.713 2.275 . . . . 0.0 112.523 -172.021 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.1 p . . . . . 0 C--O 1.245 0.844 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -75.93 125.8 29.8 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -173.105 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 90.9 t -102.07 139.22 23.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.11 105.97 13.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 169.071 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -104.32 133.35 49.36 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.9 p90 . . . . . 0 N--CA 1.474 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.019 -175.278 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -144.14 148.33 34.91 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.93 0.871 . . . . 0.0 113.263 -167.569 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.7 mp -120.99 155.65 33.83 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.85 -1.523 . . . . 0.0 107.855 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -118.15 130.66 56.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.348 0.659 . . . . 0.0 110.252 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.75 153.05 48.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.358 1.463 . . . . 0.0 109.206 -175.334 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 56' ' ' GLU . . . . . 0.432 ' HB2' HE22 ' A' ' 60' ' ' GLN . 14.7 mm-40 -72.01 -29.86 64.63 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.187 0.595 . . . . 0.0 111.745 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.9 p -136.44 163.42 30.52 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.431 0.692 . . . . 0.0 110.758 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -57.5 -44.58 85.12 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.796 0.838 . . . . 0.0 110.615 172.162 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 59' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 41.8 mt-10 -56.61 -39.09 72.99 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 124.677 1.235 . . . . 0.0 111.969 -174.919 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 60' ' ' GLN . . . . . 0.432 HE22 ' HB2' ' A' ' 56' ' ' GLU . 78.6 mt-30 -64.04 -39.66 94.57 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.484 0.714 . . . . 0.0 111.541 175.096 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.4 -40.05 62.27 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.302 0.641 . . . . 0.0 111.768 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 62' ' ' GLU . . . . . 0.514 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.7 pt-20 -76.82 -43.01 38.18 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.135 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.99 -27.21 65.49 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 123.168 0.587 . . . . 0.0 111.431 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -64.21 -54.31 35.48 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 172.694 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.33 -48.41 74.22 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.586 1.154 . . . . 0.0 111.833 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -60.7 -43.9 97.21 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.421 1.088 . . . . 0.0 111.432 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -64.0 -28.1 69.58 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.587 1.155 . . . . 0.0 111.552 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.87 -13.53 27.1 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.264 0.626 . . . . 0.0 111.116 177.622 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.02 -1.12 82.8 Favored Glycine 0 C--N 1.354 1.529 0 O-C-N 123.332 0.395 . . . . 0.0 113.252 -176.349 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.8 mt -63.17 110.67 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.294 0 CA-C-O 121.836 0.827 . . . . 0.0 110.807 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -65.68 137.28 57.21 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.352 -1.749 . . . . 0.0 109.137 171.595 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -140.44 149.76 42.98 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.669 0.668 . . . . 0.0 112.486 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -108.52 111.59 23.53 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.164 0.986 . . . . 0.0 109.5 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 76.7 t -79.64 118.22 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.477 0.711 . . . . 0.0 109.819 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 27.6 mt -122.86 97.48 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.438 1.495 . . . . 0.0 107.495 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.8 mt . . . . . 0 CA--C 1.554 1.109 0 C-N-CA 123.264 0.626 . . . . 0.0 112.386 -173.831 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 3' ' ' ALA . . . . . 0.487 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.28 128.84 47.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.234 0.614 . . . . 0.0 109.998 -174.806 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -109.04 123.79 49.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 176.698 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 5' ' ' ILE . . . . . 0.544 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.7 mp -109.17 121.14 61.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -148.42 170.87 17.05 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -172.911 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -139.36 96.3 8.86 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.32 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 C--N 1.371 1.76 0 C-N-CA 122.488 2.125 . . . . 0.0 112.023 -173.351 . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.48 1.057 0 CA-C-O 120.588 0.232 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -88.79 129.1 35.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.414 1.085 . . . . 0.0 108.86 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -101.35 137.28 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.429 HD21 ' HB1' ' A' ' 3' ' ' ALA . 5.6 tt -112.45 108.56 17.74 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 175.017 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -114.14 132.7 55.98 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' PHE . . . . . 0.487 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 3.3 p90 . . . . . 0 C--O 1.241 0.643 0 CA-C-O 121.555 0.693 . . . . 0.0 112.615 -178.318 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.2 t . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 52' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 6.5 ptpp? -138.8 134.48 33.46 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.331 172.917 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.24 159.88 18.87 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.952 1.301 . . . . 0.0 107.749 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -125.82 129.82 50.16 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.17 0.509 . . . . 0.0 110.118 170.417 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -127.04 150.36 49.48 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.547 1.539 . . . . 0.0 108.734 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -72.43 -26.15 61.74 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.412 0.685 . . . . 0.0 111.763 -176.647 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.1 p -130.34 159.78 35.93 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.453 0.701 . . . . 0.0 109.619 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -62.71 -39.26 93.47 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.495 171.423 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -55.33 -41.12 72.02 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.367 1.042 . . . . 0.0 111.874 -176.077 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -68.21 -32.78 73.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.099 0.56 . . . . 0.0 111.395 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.45 -41.44 21.82 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.506 0.723 . . . . 0.0 111.326 -175.934 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.39 -38.91 74.76 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.843 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.36 71.09 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.159 0.584 . . . . 0.0 112.078 175.058 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -63.33 -59.15 5.09 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.73 73.7 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.12 0.968 . . . . 0.0 111.662 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -65.86 -42.65 90.16 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.178 0.991 . . . . 0.0 111.799 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -55.66 -38.34 69.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.566 1.146 . . . . 0.0 110.684 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -80.77 -26.41 37.27 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.823 0.849 . . . . 0.0 110.754 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.86 -5.26 69.07 Favored Glycine 0 C--N 1.349 1.301 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.541 -169.741 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.68 112.13 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-O 121.437 0.637 . . . . 0.0 110.644 -178.09 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.95 135.34 36.82 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 113.149 -1.841 . . . . 0.0 108.821 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -143.04 145.93 33.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.428 0.558 . . . . 0.0 111.207 -170.627 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -125.64 114.01 18.14 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' VAL . . . . . 0.544 HG12 ' HB ' ' A' ' 5' ' ' ILE . 24.5 m -84.53 139.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.92 0.488 . . . . 0.0 111.077 177.522 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.83 126.29 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.469 1.508 . . . . 0.0 107.412 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.8 mt . . . . . 0 CA--C 1.551 0.983 0 C-N-CA 122.927 0.491 . . . . 0.0 110.535 177.943 . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.6 p -106.87 124.0 48.98 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.99 0.516 . . . . 0.0 110.776 -175.955 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -102.6 127.53 49.65 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.844 0.858 . . . . 0.0 109.172 175.734 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB2' HD13 ' A' ' 75' ' ' ILE . 17.2 ptpt -108.72 124.23 50.23 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -177.833 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.462 HG13 HD13 ' A' ' 25' ' ' LEU . 4.0 mp -107.87 121.24 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.483 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.9 p90 -150.59 160.05 44.08 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.429 0.633 . . . . 0.0 112.132 -173.483 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.585 ' HB2' ' HB3' ' A' ' 77' ' ' PRO . 11.9 mtp180 -122.16 96.61 46.3 Favored Pre-proline 0 N--CA 1.478 0.97 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 168.256 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.57 ' HG2' ' HA ' ' A' ' 11' ' ' THR . 73.1 Cg_endo -74.8 165.34 31.68 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 122.623 2.215 . . . . 0.0 111.676 178.297 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.71 -41.19 99.02 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.72 0.808 . . . . 0.0 110.466 177.881 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -112.72 112.26 23.64 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 107.678 -1.231 . . . . 0.0 107.678 170.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.57 ' HA ' ' HG2' ' A' ' 8' ' ' PRO . 7.8 p -93.29 154.55 17.93 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.685 0.794 . . . . 0.0 111.948 -170.682 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.03 96.54 0.62 Allowed 'General case' 0 C--N 1.354 0.769 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 171.251 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.491 ' HA ' ' HB3' ' A' ' 18' ' ' ALA . 57.2 mtt -73.11 -25.48 60.88 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.101 -174.899 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 56.73 87.93 0.05 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.016 1.326 . . . . 0.0 111.095 174.735 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.1 t 63.71 17.41 10.43 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 124.165 0.986 . . . . 0.0 111.314 -174.928 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.22 28.85 73.15 Favored Glycine 0 C--N 1.354 1.568 0 CA-C-N 115.957 -0.565 . . . . 0.0 113.787 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 76.4 p -82.71 -41.83 18.8 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.743 0.417 . . . . 0.0 111.561 -177.76 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.491 ' HB3' ' HA ' ' A' ' 13' ' ' MET . . . -66.61 134.89 53.25 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.593 0.757 . . . . 0.0 111.515 -177.318 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -93.68 -72.08 0.63 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.798 0.839 . . . . 0.0 109.559 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 30.0 p -81.43 -179.82 7.53 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 123.671 0.788 . . . . 0.0 110.354 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.449 ' HA ' HG21 ' A' ' 11' ' ' THR . 13.3 m120 -66.97 92.21 0.23 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.344 0.592 . . . . 0.0 109.832 176.437 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.7 p -71.06 153.19 8.4 Favored 'Isoleucine or valine' 0 C--O 1.249 1.076 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.169 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.412 ' CH2' ' HD3' ' A' ' 77' ' ' PRO . 75.7 m95 -82.51 125.43 31.11 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 177.284 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.9 t -100.07 135.97 33.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.53 HD11 ' HB1' ' A' ' 3' ' ' ALA . 51.2 tp -116.37 104.0 11.03 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 36.6 tt0 -104.97 135.92 45.41 Favored 'General case' 0 C--O 1.214 -0.772 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 176.841 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -142.62 153.68 43.7 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.559 0.618 . . . . 0.0 111.876 -178.642 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -61.42 86.84 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.025 165.612 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.48 ' HB2' HG22 ' A' ' 51' ' ' VAL . . . -77.67 111.92 13.95 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 115.007 -0.997 . . . . 0.0 109.284 177.597 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.77 113.12 8.47 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.734 -177.183 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 p -103.59 95.96 8.08 Favored Pre-proline 0 CA--C 1.556 1.179 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 167.027 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.97 -163.57 0.13 Allowed 'Trans proline' 0 C--N 1.38 2.226 0 C-N-CA 123.314 2.676 . . . . 0.0 113.11 -171.629 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -61.06 98.03 0.07 Allowed 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 122.446 1.117 . . . . 0.0 110.236 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -149.34 80.37 1.4 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.0 1.32 . . . . 0.0 108.545 -169.11 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.9 pp -82.41 154.42 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.917 173.705 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -85.38 132.01 46.26 Favored Pre-proline 0 N--CA 1.474 0.746 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.875 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -59.76 -27.15 84.27 Favored 'Trans proline' 0 C--N 1.372 1.78 0 C-N-CA 122.939 2.426 . . . . 0.0 113.469 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.3 mm -74.66 -42.2 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 121.338 0.59 . . . . 0.0 109.856 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 57.7 mtt -85.72 -18.57 32.71 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.557 -174.199 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.31 -124.66 30.24 Favored Glycine 0 C--N 1.349 1.282 0 O-C-N 123.463 0.477 . . . . 0.0 112.349 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -73.84 105.8 5.28 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 173.044 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 t -125.51 103.66 8.0 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.746 0.818 . . . . 0.0 109.975 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.5 t -68.12 -20.56 64.93 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.602 0.761 . . . . 0.0 110.584 173.162 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.4 t -76.44 78.27 3.16 Favored 'General case' 0 C--N 1.355 0.818 0 CA-C-O 121.838 0.828 . . . . 0.0 109.569 174.665 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.0 t -165.36 93.91 0.61 Allowed 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -62.93 148.32 47.78 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.304 0.642 . . . . 0.0 110.013 -176.201 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.425 ' N ' ' SD ' ' A' ' 47' ' ' MET . 1.1 mpt? -50.84 -59.35 4.21 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.635 1.174 . . . . 0.0 112.194 -170.444 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.3 175.46 9.38 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.943 0.897 . . . . 0.0 109.393 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -138.12 148.93 45.45 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.551 1.14 . . . . 0.0 108.689 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -108.18 87.57 2.53 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 122.009 0.909 . . . . 0.0 110.347 -174.844 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.48 HG22 ' HB2' ' A' ' 29' ' ' ALA . 15.6 m -95.56 166.52 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.525 -0.734 . . . . 0.0 109.614 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -142.9 149.28 38.26 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-O 122.025 0.917 . . . . 0.0 113.437 -173.44 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.42 HD12 HD23 ' A' ' 25' ' ' LEU . 50.5 mt -119.2 158.9 25.06 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.522 1.929 . . . . 0.0 107.588 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.1 p -122.31 129.05 51.78 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 118.43 0.559 . . . . 0.0 110.622 175.049 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -130.63 148.53 52.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.258 1.423 . . . . 0.0 108.936 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.09 -22.36 62.11 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.771 0.428 . . . . 0.0 111.579 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.3 p -132.47 157.21 45.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.217 0.607 . . . . 0.0 111.169 178.17 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -58.82 -43.85 90.71 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.276 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -59.05 -35.54 73.52 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.687 1.242 . . . . 0.0 111.494 -175.047 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -74.03 -30.02 62.21 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.076 0.551 . . . . 0.0 112.04 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.33 -37.83 31.79 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.366 0.603 . . . . 0.0 110.903 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -71.92 -37.71 70.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.368 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.39 70.61 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.645 0.778 . . . . 0.0 112.171 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -61.3 -60.3 3.94 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.073 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB1' ' O ' ' A' ' 70' ' ' ILE . . . -51.99 -47.69 64.76 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.973 1.309 . . . . 0.0 112.046 -177.761 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 55.6 mt-30 -60.81 -46.47 90.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.369 1.068 . . . . 0.0 111.341 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.7 ttt85 -63.36 -31.81 73.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.588 1.155 . . . . 0.0 111.396 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.21 -14.81 35.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.177 0.591 . . . . 0.0 111.462 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.04 -3.4 76.93 Favored Glycine 0 C--N 1.35 1.348 0 C-N-CA 122.823 0.249 . . . . 0.0 112.789 -176.336 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.407 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 59.3 mt -69.29 106.46 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -55.1 143.88 25.65 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.397 170.528 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -135.8 146.84 47.97 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.61 0.641 . . . . 0.0 112.116 -170.836 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -114.36 125.36 53.78 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 171.249 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 90.9 t -90.45 126.73 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 110.16 175.393 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.483 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 mp -105.93 112.39 39.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 170.381 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.67 153.64 50.76 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 123.633 0.773 . . . . 0.0 111.665 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.599 ' HB2' ' HG2' ' A' ' 79' ' ' GLU . 47.2 Cg_endo -64.16 169.09 11.23 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 122.702 2.268 . . . . 0.0 112.839 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.21 30.44 0.18 Allowed 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.411 1.084 . . . . 0.0 112.214 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.599 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 9.3 pt-20 -159.23 6.21 0.1 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.164 1.386 . . . . 0.0 110.391 -169.939 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.064 0 C-N-CA 123.587 0.755 . . . . 0.0 111.601 -175.149 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.538 ' SD ' ' HB3' ' A' ' 30' ' ' GLU . 52.4 ttp . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 . . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.8 p -130.59 119.26 22.23 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 177.258 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.49 134.59 44.35 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.87 0.468 . . . . 0.0 110.908 -167.629 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.56 122.82 48.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 176.882 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.513 ' HB ' HG12 ' A' ' 74' ' ' VAL . 5.1 mp -107.21 122.57 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -147.78 172.99 13.24 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -175.46 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.484 ' O ' ' HB3' ' A' ' 77' ' ' PRO . 27.5 ttp180 -116.48 119.99 35.31 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 170.086 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.503 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 29.6 Cg_endo -59.59 97.38 0.1 Allowed 'Trans proline' 0 CA--C 1.55 1.319 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 177.807 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.51 -8.82 40.35 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.493 165.233 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.25 30.81 4.65 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.882 1.273 . . . . 0.0 109.833 170.042 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 m -45.45 132.47 7.99 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.423 1.489 . . . . 0.0 113.418 -163.021 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.99 143.81 30.9 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 124.335 1.022 . . . . 0.0 110.608 176.063 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 83.8 mtp -59.5 113.91 2.44 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 123.951 0.782 . . . . 0.0 110.929 -174.072 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -68.04 82.71 0.22 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.124 0.97 . . . . 0.0 110.165 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.4 t -85.96 -69.64 0.65 Allowed 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.531 0.732 . . . . 0.0 109.829 -176.818 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -100.79 25.63 27.61 Favored Glycine 0 C--N 1.346 1.128 0 CA-C-N 116.297 -0.411 . . . . 0.0 112.245 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.401 ' OG1' ' HG2' ' A' ' 19' ' ' LYS . 9.8 t -151.62 171.08 18.19 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.864 0.866 . . . . 0.0 109.569 -179.17 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -155.9 32.1 0.35 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.135 0.974 . . . . 0.0 109.279 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG2' ' OG1' ' A' ' 17' ' ' THR . 14.5 mmmm -68.12 141.59 56.04 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.348 -177.201 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 46.0 p -67.6 153.96 42.52 Favored 'General case' 0 C--O 1.244 0.772 0 O-C-N 124.093 0.871 . . . . 0.0 110.473 177.223 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -75.68 98.5 4.09 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.828 0.823 . . . . 0.0 111.442 -169.98 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.503 ' O ' ' HD2' ' A' ' 8' ' ' PRO . 28.8 m -96.59 -174.69 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.172 175.232 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.7 m95 -93.11 132.75 36.96 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.39 0.676 . . . . 0.0 109.319 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.487 HG22 HG22 ' A' ' 54' ' ' THR . 70.3 t -102.54 138.66 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 tt -112.99 108.26 17.1 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -119.94 131.15 55.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.602 ' HE2' ' HG3' ' A' ' 30' ' ' GLU . 35.0 p90 -144.74 158.4 43.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.522 0.729 . . . . 0.0 111.058 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.23 122.27 20.79 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 168.405 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.483 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . . . -59.19 152.51 20.4 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -160.837 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.602 ' HG3' ' HE2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -100.84 14.11 32.8 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.501 175.272 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -65.39 118.26 48.64 Favored Pre-proline 0 CA--C 1.556 1.184 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.783 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.79 -164.74 0.28 Allowed 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 122.555 2.17 . . . . 0.0 112.96 -172.491 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -58.0 -28.94 64.87 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.848 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -76.83 79.99 3.42 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.215 1.006 . . . . 0.0 109.611 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 64.9 mt -98.89 140.03 19.39 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 170.136 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.54 124.52 62.8 Favored Pre-proline 0 CA--C 1.542 0.649 0 C-N-CA 124.218 1.007 . . . . 0.0 111.537 -175.956 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.1 -19.37 40.9 Favored 'Trans proline' 0 C--N 1.377 2.048 0 C-N-CA 123.353 2.702 . . . . 0.0 112.777 175.271 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.4 mm -58.68 -48.47 85.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 124.476 1.111 . . . . 0.0 110.312 173.1 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 63.0 mtt -77.5 -37.26 51.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.247 0.619 . . . . 0.0 110.349 174.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.62 124.99 0.75 Allowed Glycine 0 C--N 1.337 0.601 0 N-CA-C 110.386 -1.085 . . . . 0.0 110.386 -178.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -74.4 90.67 2.18 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.4 p -87.58 140.06 29.91 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.967 -173.867 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.9 m -73.86 -33.35 64.06 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.16 162.92 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.5 t 67.09 82.14 0.19 Allowed 'General case' 0 C--N 1.354 0.789 0 C-N-CA 125.411 1.484 . . . . 0.0 111.461 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 32.0 t -97.26 -14.81 21.13 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 114.999 -1.001 . . . . 0.0 109.609 170.172 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -100.37 167.25 10.52 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.292 1.037 . . . . 0.0 110.773 -175.25 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -88.37 175.97 7.4 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.483 0.713 . . . . 0.0 111.588 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -93.06 130.36 38.69 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.189 -169.957 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.13 173.68 5.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.906 0.882 . . . . 0.0 110.736 177.537 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.67 152.92 26.88 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.575 0.702 . . . . 0.0 111.024 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.8 m -140.17 147.53 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 CA-C-N 114.327 -1.306 . . . . 0.0 109.435 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.5 136.03 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.676 0.75 . . . . 0.0 111.363 -175.444 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.5 mp -123.81 153.91 40.33 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.591 1.556 . . . . 0.0 107.448 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.487 HG22 HG22 ' A' ' 24' ' ' VAL . 17.1 p -120.54 125.18 47.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.381 0.991 . . . . 0.0 111.154 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -124.44 145.49 49.47 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.905 1.682 . . . . 0.0 107.448 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 45.8 mt-10 -69.99 -22.63 63.12 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -172.933 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 45.1 p -135.72 162.38 32.93 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 110.146 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -61.64 -40.93 96.66 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.57 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -59.49 -39.54 84.09 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.713 0.805 . . . . 0.0 111.585 -175.007 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -67.7 -33.21 74.45 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.936 0.495 . . . . 0.0 111.337 178.926 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.03 -39.68 25.43 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.148 0.499 . . . . 0.0 111.046 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.38 -39.0 63.0 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.305 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.29 -32.34 73.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.485 0.714 . . . . 0.0 111.76 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -66.69 -49.25 66.7 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.16 84.07 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.094 0.958 . . . . 0.0 111.187 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.6 mt-30 -62.64 -42.96 99.89 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.957 0.903 . . . . 0.0 111.324 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -55.48 -36.74 66.94 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.965 1.306 . . . . 0.0 110.825 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -87.09 -21.0 26.3 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.041 -0.982 . . . . 0.0 110.882 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.62 -10.68 66.74 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.265 -0.742 . . . . 0.0 112.536 -174.503 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.45 HG12 ' SD ' ' A' ' 1' ' ' MET . 52.7 mt -52.63 114.3 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.818 0.847 . . . . 0.0 111.512 -173.224 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -58.14 130.4 46.44 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 113.861 -1.518 . . . . 0.0 108.739 170.274 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -142.16 146.64 35.53 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.045 0.45 . . . . 0.0 111.509 -169.875 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -114.86 133.81 55.66 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.683 1.193 . . . . 0.0 107.797 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.513 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.7 m -103.32 127.48 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-O 121.389 0.614 . . . . 0.0 109.426 174.545 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.26 132.25 68.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 C-N-CA 125.432 1.493 . . . . 0.0 107.282 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 34.4 mt -75.27 149.37 84.48 Favored Pre-proline 0 C--O 1.24 0.564 0 O-C-N 122.997 0.186 . . . . 0.0 110.573 173.84 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.6 ' HB2' ' HG2' ' A' ' 79' ' ' GLU . 48.7 Cg_endo -67.89 158.88 55.36 Favored 'Trans proline' 0 C--N 1.37 1.684 0 C-N-CA 122.063 1.842 . . . . 0.0 111.269 174.929 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -27.18 69.11 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.668 0.387 . . . . 0.0 110.677 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.6 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 17.0 pt-20 -71.15 -28.27 64.15 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.2 1.0 . . . . 0.0 111.27 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.356 0.849 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 176.707 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.564 ' SD ' ' NZ ' ' A' ' 48' ' ' LYS . 7.7 mmt . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 . . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 50.4 m -125.66 117.23 23.06 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.11 136.41 41.0 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.965 0.506 . . . . 0.0 109.716 -173.935 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -108.24 123.55 48.95 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.481 HG12 HD13 ' A' ' 25' ' ' LEU . 59.3 mt -104.29 121.04 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.225 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -146.59 176.63 9.68 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.694 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 60.3 ttt180 -136.41 94.62 13.55 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.075 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -91.32 -158.5 0.07 OUTLIER 'Trans proline' 0 C--N 1.368 1.587 0 C-N-CA 123.483 2.789 . . . . 0.0 111.559 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.52 12.81 10.08 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 172.241 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -80.51 -15.19 57.3 Favored 'General case' 0 C--N 1.349 0.558 0 C-N-CA 125.532 1.533 . . . . 0.0 111.142 -176.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.2 p -61.2 94.51 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.119 0.968 . . . . 0.0 110.452 174.997 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.76 -176.3 5.32 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.07 0.948 . . . . 0.0 110.521 177.85 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 57.7 mtm -67.09 87.23 0.15 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.916 0.487 . . . . 0.0 109.792 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 9.3 tt0 -92.65 109.24 20.65 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.4 t 61.88 23.74 14.01 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 124.278 1.031 . . . . 0.0 110.316 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.79 -41.33 2.2 Favored Glycine 0 C--N 1.353 1.522 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.603 -177.746 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.0 t -77.43 135.08 38.26 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.284 0.634 . . . . 0.0 111.802 -172.085 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -169.32 11.81 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.536 1.134 . . . . 0.0 111.409 -177.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -63.18 -33.45 75.49 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.358 0.663 . . . . 0.0 111.247 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.1 p -113.04 130.87 56.0 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 124.06 0.944 . . . . 0.0 108.73 173.015 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -78.46 102.29 7.75 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 172.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.8 m -79.71 -179.41 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 123.316 0.647 . . . . 0.0 111.547 -177.13 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -84.88 129.54 34.79 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.9 t -102.74 138.49 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.396 0.617 . . . . 0.0 109.739 175.988 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.481 HD13 HG12 ' A' ' 5' ' ' ILE . 60.4 tp -116.06 105.49 12.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -114.41 131.11 56.7 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -146.67 157.05 43.62 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.236 1.014 . . . . 0.0 110.713 178.21 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -69.56 128.42 36.42 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 106.126 -1.805 . . . . 0.0 106.126 164.459 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 49' ' ' GLN . . . -52.43 141.42 19.92 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -164.933 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -80.5 48.02 1.0 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.53 1.132 . . . . 0.0 110.522 177.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -114.13 130.53 23.84 Favored Pre-proline 0 CA--C 1.548 0.901 0 O-C-N 122.018 -0.426 . . . . 0.0 110.139 -172.741 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -82.82 -148.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.365 1.417 0 C-N-CA 122.49 2.126 . . . . 0.0 110.298 164.574 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.9 ppt_? -82.8 50.7 1.74 Allowed 'General case' 0 CA--C 1.558 1.276 0 CA-C-O 121.424 0.63 . . . . 0.0 110.242 167.986 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -80.95 72.85 7.98 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 123.992 0.917 . . . . 0.0 109.461 -175.782 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.633 HD12 ' HA ' ' A' ' 42' ' ' THR . 6.1 pt -144.81 145.15 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.904 1.282 . . . . 0.0 108.709 -173.145 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -109.58 156.0 40.37 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 123.314 0.646 . . . . 0.0 110.904 -177.411 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -59.5 -34.44 97.04 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 122.57 2.18 . . . . 0.0 111.136 171.73 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.22 -37.95 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.102 0.961 . . . . 0.0 110.612 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 64.0 mtt -67.14 -35.37 79.57 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.498 0.719 . . . . 0.0 111.426 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.35 18.55 76.91 Favored Glycine 0 C--N 1.347 1.157 0 O-C-N 123.619 0.575 . . . . 0.0 112.922 -177.258 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -104.62 26.43 9.07 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.873 0.869 . . . . 0.0 109.179 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.633 ' HA ' HD12 ' A' ' 35' ' ' ILE . 20.0 p -81.37 -30.33 33.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.799 0.84 . . . . 0.0 112.453 -174.884 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.9 t -67.53 -44.71 77.7 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.263 0.554 . . . . 0.0 109.595 175.136 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.0 m -91.13 71.67 6.3 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.474 175.545 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 22.9 t -70.55 94.21 0.97 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.397 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -71.15 121.69 18.79 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.941 -174.147 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 54.7 mtt -88.05 -43.4 11.74 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.65 0.78 . . . . 0.0 110.677 -176.516 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.564 ' NZ ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -172.49 86.46 0.07 Allowed 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 121.601 0.715 . . . . 0.0 111.045 178.501 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.409 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 25.5 pt20 -74.5 141.95 44.85 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 171.628 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -70.6 133.59 46.85 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.627 -0.67 . . . . 0.0 109.751 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.0 m -137.45 149.63 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-N 114.68 -1.145 . . . . 0.0 109.087 -173.374 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -142.62 136.25 28.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.631 0.729 . . . . 0.0 111.377 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.4 mp -121.64 147.59 45.66 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 113.866 -1.516 . . . . 0.0 107.2 -178.295 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.4 p -113.16 132.55 55.43 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.261 0.624 . . . . 0.0 110.186 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.7 m-85 -132.85 148.24 52.3 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.298 1.439 . . . . 0.0 108.509 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.411 ' HB2' HE22 ' A' ' 60' ' ' GLN . 44.0 mt-10 -70.15 -26.75 64.08 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 123.283 0.364 . . . . 0.0 111.915 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 58.6 p -133.17 163.27 29.66 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.05 0.54 . . . . 0.0 110.096 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -62.13 -39.1 91.42 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 114.959 -1.018 . . . . 0.0 110.828 171.263 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -53.06 -43.16 66.47 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.473 1.109 . . . . 0.0 111.469 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.489 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 64.3 mt-30 -67.74 -36.25 80.21 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.064 0.945 . . . . 0.0 111.395 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.03 -39.7 55.1 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.973 0.509 . . . . 0.0 111.127 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -70.85 -37.48 73.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.562 177.007 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.37 -38.72 69.21 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.523 0.729 . . . . 0.0 111.925 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -63.39 -60.62 3.14 Favored 'General case' 0 C--N 1.351 0.64 0 C-N-CA 123.325 0.65 . . . . 0.0 110.005 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.41 -47.41 66.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.489 1.115 . . . . 0.0 112.293 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -61.9 -45.8 92.17 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.006 0.922 . . . . 0.0 111.452 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -59.72 -34.37 72.84 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.081 0.952 . . . . 0.0 110.936 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -86.87 -20.56 27.26 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.333 0.653 . . . . 0.0 111.407 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.18 2.05 74.73 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 116.643 -0.253 . . . . 0.0 112.786 -173.842 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.97 110.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 122.568 0.347 . . . . 0.0 110.179 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.6 pt-20 -58.58 136.93 57.71 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 124.95 1.407 . . . . 0.0 108.407 170.494 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -144.42 151.52 39.36 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.357 0.526 . . . . 0.0 110.997 -171.906 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.459 ' NH1' HG13 ' A' ' 75' ' ' ILE . 3.5 tmt_? -125.44 140.34 52.86 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.516 1.127 . . . . 0.0 108.26 171.4 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -105.57 136.84 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.352 0.661 . . . . 0.0 111.032 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.459 HG13 ' NH1' ' A' ' 73' ' ' ARG . 2.3 mp -111.26 150.47 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.4 mt -74.67 154.87 87.38 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 122.841 0.457 . . . . 0.0 110.987 173.959 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.694 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 40.8 Cg_endo -64.35 169.47 10.92 Favored 'Trans proline' 0 C--N 1.379 2.169 0 C-N-CA 123.317 2.678 . . . . 0.0 114.336 -177.404 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -66.53 -19.96 65.91 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.729 0.812 . . . . 0.0 111.438 172.061 . . . . . . . . 3 3 . 1 . 003 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.568 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 11.4 pt-20 -96.96 10.95 37.7 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.24 1.016 . . . . 0.0 111.15 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.354 0.771 0 C-N-CA 122.963 0.505 . . . . 0.0 110.632 -178.979 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 mmt . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.9 m -116.77 133.71 55.69 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.035 0.534 . . . . 0.0 111.197 -172.291 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -102.31 144.39 30.86 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -107.71 124.92 50.73 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.62 HG21 ' HG2' ' A' ' 58' ' ' GLN . 70.3 mt -103.28 123.71 56.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.315 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 172.073 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -148.46 176.22 10.49 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.347 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.584 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 60.2 ttt180 -141.68 97.52 6.59 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 174.099 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -73.13 157.72 50.18 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.715 1.61 . . . . 0.0 111.714 -176.108 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.85 -31.41 66.64 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.48 173.758 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -136.08 116.18 13.38 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.536 1.134 . . . . 0.0 109.063 173.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.2 p -74.72 -24.21 58.7 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.392 0.677 . . . . 0.0 110.642 175.983 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -162.44 -160.37 0.65 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.983 1.313 . . . . 0.0 107.521 176.424 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 62.8 mtt -67.4 110.67 3.68 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 171.341 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -117.25 59.87 0.76 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.68 0.792 . . . . 0.0 111.411 -171.784 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.6 p -144.27 114.8 7.63 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.029 0.532 . . . . 0.0 110.072 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.75 23.6 61.82 Favored Glycine 0 C--N 1.348 1.231 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.493 -177.294 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.0 t -142.32 177.19 8.43 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.669 0.787 . . . . 0.0 110.062 -176.066 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.85 132.54 53.4 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.416 0.687 . . . . 0.0 111.266 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.484 ' HE2' ' HA ' ' A' ' 19' ' ' LYS . 9.6 mmpt? -74.79 87.46 2.24 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 13.2 t -101.5 31.28 3.83 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.536 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -71.53 76.6 0.79 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.267 1.027 . . . . 0.0 110.076 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.7 m -119.73 -170.58 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.022 1.329 . . . . 0.0 109.8 -176.295 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -85.17 132.17 34.33 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.6 t -101.06 139.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.13 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.516 HD23 HG12 ' A' ' 5' ' ' ILE . 3.4 tm? -116.84 104.6 11.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -107.81 137.48 45.75 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -124.44 159.75 29.77 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.174 0.59 . . . . 0.0 109.9 -178.887 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.513 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 29.0 t70 -97.98 93.65 6.43 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 -177.917 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.529 ' HB1' HG12 ' A' ' 31' ' ' VAL . . . -59.46 134.95 57.48 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.197 178.872 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -91.21 31.26 1.14 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.634 0.774 . . . . 0.0 110.758 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.529 HG12 ' HB1' ' A' ' 29' ' ' ALA . 9.2 p -133.77 112.41 12.59 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 122.915 0.486 . . . . 0.0 110.2 -169.81 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.683 ' HA ' ' H ' ' A' ' 48' ' ' LYS . 77.4 Cg_endo -78.69 -154.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.378 2.086 0 C-N-CA 123.306 2.67 . . . . 0.0 112.143 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.532 ' HG3' ' HD3' ' A' ' 34' ' ' LYS . 28.7 ptt180 -44.8 -29.62 0.82 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.903 1.281 . . . . 0.0 114.158 178.081 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 34' ' ' LYS . . . . . 0.532 ' HD3' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -73.82 82.75 1.64 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.643 0.377 . . . . 0.0 110.348 178.091 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.41 HD12 ' HB3' ' A' ' 44' ' ' SER . 80.9 mt -129.27 158.97 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 125.247 1.419 . . . . 0.0 108.342 177.762 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -41.01 131.72 1.91 Allowed Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 124.964 1.306 . . . . 0.0 112.097 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -57.86 -19.1 37.7 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 123.335 2.69 . . . . 0.0 113.364 -176.335 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.0 mm -64.17 -39.46 85.57 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 C-N-CA 124.511 1.124 . . . . 0.0 111.106 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -137.94 23.74 2.83 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.666 0.787 . . . . 0.0 111.055 -173.331 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -120.06 -52.51 0.26 Allowed Glycine 0 N--CA 1.47 0.953 0 CA-C-O 120.059 -0.301 . . . . 0.0 113.566 -171.103 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -58.98 100.85 0.08 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.482 0.713 . . . . 0.0 110.913 -177.308 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.733 ' HA ' ' HB2' ' A' ' 45' ' ' SER . 81.9 p 68.22 -22.23 0.13 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 126.86 2.064 . . . . 0.0 114.366 174.89 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 t -73.4 -19.91 60.87 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.82 0.848 . . . . 0.0 110.061 170.691 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.41 ' HB3' HD12 ' A' ' 35' ' ' ILE . 51.4 m -136.52 56.04 1.82 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.479 1.112 . . . . 0.0 108.705 174.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.733 ' HB2' ' HA ' ' A' ' 42' ' ' THR . 23.1 t -87.64 35.03 0.71 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.895 0.878 . . . . 0.0 110.683 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -132.72 166.43 22.23 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.028 0.931 . . . . 0.0 110.074 -175.989 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.2 pmm? -83.77 111.15 18.92 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.383 175.085 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.683 ' H ' ' HA ' ' A' ' 32' ' ' PRO . 84.5 mttt 70.43 110.34 0.06 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.936 1.294 . . . . 0.0 111.791 170.115 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -89.48 101.95 14.63 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 121.043 0.449 . . . . 0.0 110.53 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.513 ' HG3' ' HA ' ' A' ' 28' ' ' ASP . 26.7 mp0 -76.37 88.38 3.16 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.391 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.88 164.2 2.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 C-N-CA 124.551 1.14 . . . . 0.0 108.498 -174.768 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -137.44 146.54 44.47 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.772 0.796 . . . . 0.0 111.628 -173.723 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp -119.61 157.27 28.77 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.978 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 48.5 p -121.73 131.6 54.17 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 110.193 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -128.17 147.49 50.56 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.503 1.521 . . . . 0.0 107.982 178.587 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.05 -24.21 64.15 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.656 0.382 . . . . 0.0 111.84 -176.736 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 79.8 p -132.99 160.5 36.96 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 123.927 0.891 . . . . 0.0 110.193 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.62 ' HG2' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -60.88 -40.41 92.91 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.078 0.951 . . . . 0.0 110.317 170.803 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -57.3 -39.7 76.32 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.75 1.22 . . . . 0.0 111.754 -174.573 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 97.5 mt-30 -70.93 -30.78 67.19 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 122.963 0.505 . . . . 0.0 112.013 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.2 -40.08 53.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.202 0.601 . . . . 0.0 111.14 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -37.59 67.2 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.951 177.724 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.78 77.24 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.244 0.618 . . . . 0.0 111.98 173.342 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -65.61 -59.33 4.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.532 0.733 . . . . 0.0 110.384 176.904 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.28 -49.52 69.42 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.544 1.138 . . . . 0.0 112.583 -177.949 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -64.18 -37.84 88.9 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.402 0.681 . . . . 0.0 111.73 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -62.17 -30.96 71.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.929 0.892 . . . . 0.0 110.692 175.891 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -85.92 -21.93 27.7 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.496 0.718 . . . . 0.0 110.629 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.6 -1.75 62.08 Favored Glycine 0 C--N 1.35 1.354 0 O-C-N 123.321 0.388 . . . . 0.0 112.722 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 26.8 mt -68.11 109.34 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-O 121.601 0.715 . . . . 0.0 110.144 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -58.08 141.34 50.38 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.772 169.02 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -141.12 149.86 42.11 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.146 0.43 . . . . 0.0 111.391 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -120.97 127.65 52.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.747 0.819 . . . . 0.0 109.494 172.955 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.402 HG22 HD12 ' A' ' 5' ' ' ILE . 35.1 t -102.51 134.83 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 123.761 0.825 . . . . 0.0 108.872 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.9 mt -130.71 121.04 49.42 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -178.704 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.8 143.58 98.07 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 123.744 0.817 . . . . 0.0 112.032 -175.217 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.584 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 47.0 Cg_endo -71.24 -176.28 1.84 Allowed 'Trans proline' 0 C--N 1.369 1.654 0 C-N-CA 123.301 2.667 . . . . 0.0 112.969 176.302 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.08 13.94 0.61 Allowed 'General case' 0 CA--C 1.558 1.267 0 CA-C-N 114.446 -1.252 . . . . 0.0 112.982 179.147 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -142.26 -9.97 0.86 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 121.104 0.478 . . . . 0.0 111.067 -179.13 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.479 ' HB3' ' O ' ' A' ' 28' ' ' ASP . 1.9 mpt? . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -120.73 122.87 41.35 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.226 0.61 . . . . 0.0 110.96 -172.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.42 137.46 37.89 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.479 0.711 . . . . 0.0 109.224 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -112.81 123.69 50.89 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 mp -105.93 123.31 60.41 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 N-CA-C 106.779 -1.564 . . . . 0.0 106.779 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -150.88 174.53 12.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.224 1.01 . . . . 0.0 108.354 -177.748 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.665 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 59.2 ttt180 -139.73 98.08 7.98 Favored Pre-proline 0 C--O 1.242 0.688 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.497 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -80.74 174.91 10.56 Favored 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 122.707 2.271 . . . . 0.0 112.186 -175.823 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.25 -18.12 60.17 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.377 0.671 . . . . 0.0 111.035 177.434 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -148.12 125.37 11.52 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.588 1.155 . . . . 0.0 107.924 170.532 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.2 p -67.41 -79.48 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.255 0.622 . . . . 0.0 111.308 -176.903 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 177.11 -64.6 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.939 1.295 . . . . 0.0 107.634 -175.85 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -85.51 106.65 17.0 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.157 0.983 . . . . 0.0 108.839 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 14' ' ' GLN . . . . . 0.422 ' HA ' ' OG1' ' A' ' 17' ' ' THR . 26.2 mm-40 -86.54 85.33 7.3 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.122 0.569 . . . . 0.0 110.722 -174.674 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 42.9 m -93.83 -75.34 0.51 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.999 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -116.93 19.6 12.02 Favored Glycine 0 C--N 1.351 1.383 0 C-N-CA 123.667 0.651 . . . . 0.0 111.72 174.183 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.422 ' OG1' ' HA ' ' A' ' 14' ' ' GLN . 74.1 p -80.01 -9.23 59.68 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.296 1.038 . . . . 0.0 111.963 -173.184 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.9 -23.92 61.56 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.184 0.594 . . . . 0.0 110.111 172.307 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -91.4 -64.7 1.09 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.642 0.777 . . . . 0.0 108.949 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.5 p -140.48 127.42 20.69 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.808 0.843 . . . . 0.0 110.334 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -78.09 161.39 27.45 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 121.39 0.614 . . . . 0.0 110.316 171.049 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m -117.19 -175.07 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.824 177.605 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -85.96 132.57 34.05 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -176.477 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.1 t -102.12 138.44 26.36 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.489 HD22 HD23 ' A' ' 53' ' ' LEU . 9.1 tt -114.82 107.81 15.92 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 172.727 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -108.7 134.84 50.88 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 174.852 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.409 ' CE2' ' HA ' ' A' ' 29' ' ' ALA . 2.1 p90 -145.29 154.33 42.23 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.546 0.612 . . . . 0.0 112.053 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.479 ' O ' ' HB3' ' A' ' 1' ' ' MET . 23.8 t70 -61.23 108.07 0.85 Allowed 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 106.97 -1.492 . . . . 0.0 106.97 162.49 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.409 ' HA ' ' CE2' ' A' ' 27' ' ' PHE . . . -61.96 152.11 33.11 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -170.804 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.77 10.07 10.35 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.05 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.2 p -95.19 133.5 26.03 Favored Pre-proline 0 CA--C 1.555 1.171 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.408 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -54.49 171.26 0.44 Allowed 'Trans proline' 0 C--N 1.374 1.909 0 C-N-CA 123.38 2.72 . . . . 0.0 114.507 170.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -65.75 -14.33 61.1 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 115.002 -0.999 . . . . 0.0 112.093 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -71.69 109.29 5.5 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 123.935 0.894 . . . . 0.0 109.857 175.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 36.7 pt -94.02 162.36 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.843 0.857 . . . . 0.0 110.757 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -88.85 149.13 43.01 Favored Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 123.577 0.751 . . . . 0.0 109.142 178.505 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.41 -33.76 38.9 Favored 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 123.315 2.676 . . . . 0.0 114.17 173.735 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.4 mt -63.59 -42.28 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 C-N-CA 122.994 0.518 . . . . 0.0 110.122 178.151 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 82.9 mtp -61.27 -59.01 5.97 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.731 0.812 . . . . 0.0 109.893 178.221 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 63.14 24.95 67.67 Favored Glycine 0 CA--C 1.534 1.261 0 O-C-N 123.724 0.64 . . . . 0.0 114.409 175.139 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -84.09 68.12 9.96 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.723 0.809 . . . . 0.0 110.11 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 67.8 p -100.44 -5.56 26.93 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.586 0.754 . . . . 0.0 111.374 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.4 p -60.89 -50.26 74.13 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.726 0.811 . . . . 0.0 110.903 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.1 m -123.01 103.5 8.63 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.164 0.986 . . . . 0.0 108.638 173.693 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 31.7 p -70.72 87.17 0.68 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.542 0.737 . . . . 0.0 110.203 178.668 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -92.11 166.46 12.64 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.53 0.732 . . . . 0.0 109.435 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.0 mmt -68.81 -36.99 78.91 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.818 0.447 . . . . 0.0 110.955 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.35 156.26 0.95 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.176 0.991 . . . . 0.0 109.942 173.678 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.44 HE21 HG22 ' A' ' 51' ' ' VAL . 13.2 pt20 -69.79 106.71 3.22 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.466 173.213 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -66.82 90.83 0.18 Allowed 'General case' 0 CA--C 1.553 1.066 0 CA-C-O 121.282 0.563 . . . . 0.0 109.683 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.44 HG22 HE21 ' A' ' 49' ' ' GLN . 58.6 t -70.05 160.73 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.389 1.075 . . . . 0.0 111.546 -171.181 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.5 ptpt -133.69 132.43 40.65 Favored 'General case' 0 C--N 1.352 0.681 0 CA-C-O 121.771 0.796 . . . . 0.0 110.826 174.764 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.489 HD23 HD22 ' A' ' 25' ' ' LEU . 2.0 mm? -115.83 148.41 39.95 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.8 p -114.86 130.93 56.98 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.67 -0.644 . . . . 0.0 109.677 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -130.84 146.48 52.29 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.469 1.507 . . . . 0.0 108.32 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -68.63 -27.16 65.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.797 0.439 . . . . 0.0 112.169 -175.908 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.4 p -134.3 159.28 41.48 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.629 0.771 . . . . 0.0 110.352 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -56.33 -46.29 79.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.65 1.18 . . . . 0.0 111.4 172.115 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -51.19 -45.42 61.81 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 124.909 1.381 . . . . 0.0 111.992 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 95.9 mt-30 -70.85 -29.14 65.18 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.609 0.764 . . . . 0.0 111.774 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.66 -44.42 28.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.033 0.533 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.49 -37.75 74.27 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.649 -177.301 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.35 -36.35 75.55 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.403 0.681 . . . . 0.0 112.302 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -62.66 -57.13 12.11 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.254 0.621 . . . . 0.0 109.905 177.883 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.58 -47.74 66.66 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.494 1.117 . . . . 0.0 111.777 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 52.6 mt-30 -60.06 -45.92 91.26 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.248 1.019 . . . . 0.0 112.004 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -60.54 -31.0 70.12 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.147 . . . . 0.0 111.172 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -87.84 -21.03 25.27 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.621 0.769 . . . . 0.0 111.059 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.52 -3.8 63.67 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-O 119.984 -0.342 . . . . 0.0 112.628 -174.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 48.1 mt -63.14 108.89 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 CA-C-O 121.048 0.452 . . . . 0.0 109.873 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -57.73 139.99 52.55 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.489 172.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.0 p90 -142.18 147.8 37.19 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.851 0.751 . . . . 0.0 112.102 -168.476 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -121.04 110.4 16.2 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 175.065 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.4 t -83.73 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.6 mt -121.65 129.17 75.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 125.931 1.692 . . . . 0.0 108.04 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.6 mt -59.58 133.89 88.9 Favored Pre-proline 0 CA--C 1.541 0.633 0 O-C-N 123.321 0.388 . . . . 0.0 110.863 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.665 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 76.9 Cg_endo -76.76 172.71 15.72 Favored 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 122.856 2.37 . . . . 0.0 113.556 -175.983 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -26.94 68.76 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 114.473 -1.239 . . . . 0.0 112.21 177.227 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -77.79 -24.65 48.79 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.427 0.691 . . . . 0.0 111.366 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.088 0 C-N-CA 123.076 0.55 . . . . 0.0 110.964 178.285 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 20.1 t -118.31 130.02 55.79 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.809 0.444 . . . . 0.0 109.884 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.66 136.55 40.35 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.608 0.763 . . . . 0.0 109.712 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -108.84 120.1 41.49 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 107.197 -1.409 . . . . 0.0 107.197 175.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.447 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.2 mp -104.54 123.15 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 177.76 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -151.48 173.04 15.06 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -176.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.818 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 68.0 ttt180 -138.84 97.16 9.05 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.082 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.7 147.76 45.65 Favored 'Trans proline' 0 C--N 1.365 1.421 0 C-N-CA 122.285 1.99 . . . . 0.0 111.502 -175.119 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.11 -34.82 77.05 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.4 0.619 . . . . 0.0 109.604 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -96.72 85.87 3.94 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.294 175.142 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.5 p -95.2 -177.19 4.04 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.512 0.725 . . . . 0.0 109.884 172.474 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.88 140.35 58.86 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 170.962 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 43.3 mtm 67.41 32.4 5.83 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.834 1.254 . . . . 0.0 110.326 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -46.98 139.11 5.87 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 125.204 1.402 . . . . 0.0 112.627 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.8 t 82.45 -31.21 0.09 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 126.273 1.829 . . . . 0.0 111.569 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -108.36 17.99 33.5 Favored Glycine 0 C--N 1.35 1.341 0 N-CA-C 111.809 -0.516 . . . . 0.0 111.809 169.917 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.2 t -92.11 44.16 1.16 Allowed 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 124.608 1.163 . . . . 0.0 110.424 -173.887 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.13 103.44 0.47 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.39 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.69 -32.94 0.16 Allowed 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.726 1.61 . . . . 0.0 112.07 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.4 t -73.14 -1.99 19.74 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 122.947 0.499 . . . . 0.0 111.117 174.01 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -61.96 108.2 0.99 Allowed 'General case' 0 C--N 1.357 0.93 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 160.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.451 HG23 HG22 ' A' ' 54' ' ' THR . 9.6 m -130.36 -179.08 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.886 0.874 . . . . 0.0 110.938 -169.933 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.6 m95 -88.88 132.75 34.54 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.068 0.947 . . . . 0.0 109.338 -172.849 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.7 t -101.44 138.84 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.511 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 53.8 tp -114.42 106.69 14.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 125.369 1.468 . . . . 0.0 107.17 176.279 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -115.46 132.38 56.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -145.75 156.83 43.86 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 123.357 0.663 . . . . 0.0 110.592 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.9 115.43 7.42 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 168.777 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.99 128.3 32.91 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.152 0.908 . . . . 0.0 111.697 -171.2 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -70.83 -4.63 25.18 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.839 0.856 . . . . 0.0 112.417 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.23 138.35 75.31 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 123.114 0.565 . . . . 0.0 109.735 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.27 -174.72 1.27 Allowed 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 122.386 2.057 . . . . 0.0 110.841 167.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.481 ' HB3' ' HA ' ' A' ' 47' ' ' MET . 3.8 ppt_? -72.3 80.82 1.01 Allowed 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 122.548 1.166 . . . . 0.0 109.676 175.683 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -138.33 27.94 2.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.305 -1.316 . . . . 0.0 108.173 -177.087 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 35.0 pt -72.94 162.94 4.2 Favored 'Isoleucine or valine' 0 C--O 1.243 0.758 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.324 175.321 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -72.73 125.11 91.37 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.466 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.62 -10.71 27.11 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 122.484 2.123 . . . . 0.0 111.783 175.8 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.4 mm -65.56 -27.65 42.17 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 124.856 1.262 . . . . 0.0 110.543 175.141 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 63.7 mtt -66.8 -61.63 1.86 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.408 0.683 . . . . 0.0 110.512 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.91 -161.9 23.19 Favored Glycine 0 C--N 1.349 1.252 0 O-C-N 123.588 0.555 . . . . 0.0 113.642 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 59.07 20.64 8.53 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.955 1.302 . . . . 0.0 112.601 175.705 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.3 t -95.25 93.82 7.52 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.932 0.893 . . . . 0.0 109.446 -177.953 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.2 p -65.77 -29.36 69.85 Favored 'General case' 0 C--N 1.355 0.821 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.302 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 43.0 p -79.4 146.05 33.02 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.969 0.907 . . . . 0.0 110.277 174.211 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.5 m -74.29 79.11 1.83 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.307 0.643 . . . . 0.0 109.581 174.817 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -72.9 116.13 13.04 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.661 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.481 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . 50.0 ttm -97.39 -29.39 13.53 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 170.483 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.53 153.13 16.98 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 124.622 1.169 . . . . 0.0 108.192 171.971 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -79.72 166.3 21.93 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.756 172.253 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -80.25 149.69 30.31 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 163.251 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 p -138.31 145.33 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -178.577 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -138.79 138.69 37.82 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.515 176.669 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp -119.18 151.71 37.86 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.451 HG22 HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -122.88 128.45 50.36 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.644 0.657 . . . . 0.0 110.539 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -129.05 154.88 46.24 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.834 1.254 . . . . 0.0 108.999 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.4 mm-40 -67.8 -29.6 68.81 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.569 0.543 . . . . 0.0 111.874 -177.424 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 56.7 p -133.04 161.14 35.15 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 123.43 0.692 . . . . 0.0 111.079 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -54.63 -48.99 71.57 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.117 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -45.37 -46.16 12.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.08 1.752 . . . . 0.0 113.288 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.2 mt-30 -70.32 -33.82 71.96 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.11 0.564 . . . . 0.0 112.039 -178.476 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.511 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -80.42 -38.06 30.93 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.305 0.574 . . . . 0.0 110.753 -174.286 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -72.1 -40.25 68.31 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.387 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.52 70.94 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.254 0.622 . . . . 0.0 112.118 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -63.81 -57.1 10.94 Favored 'General case' 0 C--N 1.352 0.695 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.468 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.89 -46.46 67.98 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.494 1.118 . . . . 0.0 112.223 177.809 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -60.12 -47.69 84.87 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.41 1.084 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -57.84 -36.28 72.08 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.779 1.232 . . . . 0.0 111.253 177.768 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -80.96 -25.38 37.41 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.594 0.758 . . . . 0.0 111.011 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.29 -5.55 63.0 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.032 0.349 . . . . 0.0 112.499 -171.362 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.72 110.62 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.343 0 C-N-CA 123.399 0.68 . . . . 0.0 110.79 -177.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 2' ' ' SER . 1.6 pm0 -54.19 138.91 37.24 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 113.645 -1.616 . . . . 0.0 109.343 169.992 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -148.21 151.2 35.1 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.0 0.818 . . . . 0.0 112.087 -170.241 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.511 HH11 HG13 ' A' ' 75' ' ' ILE . 1.2 tmt_? -121.56 125.71 47.41 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.091 0.956 . . . . 0.0 108.651 171.58 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.447 HG12 ' HB ' ' A' ' 5' ' ' ILE . 33.9 m -93.49 137.88 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.68 0.792 . . . . 0.0 110.315 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.511 HG13 HH11 ' A' ' 73' ' ' ARG . 4.1 mp -121.1 137.32 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.576 1.15 . . . . 0.0 108.325 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.1 mt -74.84 142.48 76.75 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 123.855 0.862 . . . . 0.0 111.469 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.818 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 91.4 Cg_endo -79.66 -165.82 0.37 Allowed 'Trans proline' 0 C--N 1.373 1.835 0 C-N-CA 123.355 2.703 . . . . 0.0 112.88 -178.432 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 16.67 0.42 Allowed 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 124.104 0.962 . . . . 0.0 113.14 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.406 ' HG3' ' H ' ' A' ' 80' ' ' ALA . 6.3 pt-20 -147.17 -63.56 0.28 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.846 0.858 . . . . 0.0 109.554 -177.77 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.513 ' HB2' ' HD2' ' A' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.48 1.042 0 C-N-CA 124.091 0.956 . . . . 0.0 112.225 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.636 ' HA ' ' HB2' ' A' ' 28' ' ' ASP . 80.3 mtp . . . . . 0 N--CA 1.479 0.989 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 . . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 m -116.02 125.91 53.09 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.219 1.008 . . . . 0.0 108.791 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.478 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -99.96 129.02 45.99 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.607 0.763 . . . . 0.0 109.973 -177.851 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 4' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -114.6 119.87 38.25 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.988 0.915 . . . . 0.0 108.587 179.103 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.496 HG13 HD13 ' A' ' 25' ' ' LEU . 3.6 mp -106.81 122.69 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -176.274 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -150.14 161.89 41.51 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.4 0.619 . . . . 0.0 111.73 -172.233 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.682 ' HE ' ' HB2' ' A' ' 21' ' ' ASN . 26.0 mtp180 -119.51 103.54 46.49 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.482 168.942 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.495 ' HG2' ' HA ' ' A' ' 11' ' ' THR . 61.5 Cg_endo -75.59 139.18 22.53 Favored 'Trans proline' 0 CA--C 1.55 1.281 0 C-N-CA 122.265 1.977 . . . . 0.0 112.015 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.65 -11.02 60.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.939 0.895 . . . . 0.0 111.196 173.614 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -128.34 94.01 3.79 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 164.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.495 ' HA ' ' HG2' ' A' ' 8' ' ' PRO . 59.4 m -83.93 138.42 33.16 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.425 -177.352 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.14 119.88 8.16 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 171.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 62.0 mtt -71.4 90.78 0.98 Allowed 'General case' 0 C--O 1.24 0.594 0 O-C-N 124.176 0.922 . . . . 0.0 110.85 -171.376 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -74.32 -36.44 63.7 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.761 -1.109 . . . . 0.0 108.728 169.879 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.2 p -156.43 151.6 26.43 Favored 'General case' 0 C--O 1.244 0.794 0 C-N-CA 124.696 1.199 . . . . 0.0 108.321 170.204 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -77.56 71.47 2.31 Favored Glycine 0 C--N 1.343 0.956 0 N-CA-C 112.286 -0.326 . . . . 0.0 112.286 -178.479 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.6 t -154.85 19.22 0.45 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.078 0.951 . . . . 0.0 110.316 -177.18 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.75 70.91 8.74 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 121.08 0.467 . . . . 0.0 111.548 -173.702 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -91.63 -65.63 0.99 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 168.227 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.7 p -79.7 94.26 5.69 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 164.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.682 ' HB2' ' HE ' ' A' ' 7' ' ' ARG . 11.3 m120 -66.83 141.91 57.52 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.028 -170.798 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.411 HG21 ' HB ' ' A' ' 54' ' ' THR . 14.7 p -73.81 149.92 7.79 Favored 'Isoleucine or valine' 0 C--O 1.244 0.8 0 C-N-CA 123.337 0.655 . . . . 0.0 109.768 177.266 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -85.04 127.3 34.16 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -101.43 136.94 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.581 HD23 HD12 ' A' ' 53' ' ' LEU . 58.8 tp -118.26 104.12 10.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.986 1.315 . . . . 0.0 108.715 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.58 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 43.4 mt-10 -104.68 136.92 43.31 Favored 'General case' 0 C--O 1.212 -0.921 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.218 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -143.77 149.86 37.72 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 118.499 0.591 . . . . 0.0 109.918 174.473 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.636 ' HB2' ' HA ' ' A' ' 1' ' ' MET . 8.3 m-20 -61.76 94.15 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.863 0.865 . . . . 0.0 110.272 177.77 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HB1' HG12 ' A' ' 31' ' ' VAL . . . -88.7 137.63 32.15 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.144 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -83.24 9.78 9.93 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.495 0.718 . . . . 0.0 111.315 -176.527 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.4 HG12 ' HB1' ' A' ' 29' ' ' ALA . 7.7 p -89.17 117.01 67.83 Favored Pre-proline 0 CA--C 1.562 1.433 0 C-N-CA 123.673 0.789 . . . . 0.0 110.621 179.149 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.41 ' O ' HG23 ' A' ' 35' ' ' ILE . 45.8 Cg_endo -85.26 -149.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.377 2.058 0 C-N-CA 123.263 2.642 . . . . 0.0 112.374 176.516 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -15.76 2.13 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.694 0.798 . . . . 0.0 112.493 170.55 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -78.82 61.18 3.01 Favored 'General case' 0 CA--C 1.559 1.305 0 C-N-CA 124.041 0.936 . . . . 0.0 109.097 170.774 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.41 HG23 ' O ' ' A' ' 32' ' ' PRO . 1.4 pp -88.87 -165.59 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 124.643 1.177 . . . . 0.0 111.159 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -56.33 115.78 10.88 Favored Pre-proline 0 CA--C 1.553 1.058 0 C-N-CA 123.272 0.629 . . . . 0.0 110.776 173.218 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -72.5 -7.47 20.93 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.658 2.239 . . . . 0.0 112.193 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.6 mm -59.82 -54.67 31.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 124.837 1.255 . . . . 0.0 111.029 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.0 ptp -106.71 -58.72 1.89 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.151 0.58 . . . . 0.0 110.302 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.27 114.76 0.04 OUTLIER Glycine 0 C--N 1.356 1.647 0 CA-C-O 119.961 -0.355 . . . . 0.0 113.508 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -137.28 29.23 2.74 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 117.548 0.674 . . . . 0.0 111.31 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 73.6 p -62.8 145.19 55.52 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.394 0.678 . . . . 0.0 112.127 -175.903 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 56.0 p -73.26 -53.49 10.74 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 174.874 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.4 t -173.71 -82.69 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.002 0.921 . . . . 0.0 109.254 175.665 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.3 t -116.17 38.4 3.39 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.282 1.033 . . . . 0.0 109.625 -174.158 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -71.12 145.18 49.96 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.699 0.799 . . . . 0.0 111.796 -176.46 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.7 mmt -99.29 -173.48 2.5 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.305 1.042 . . . . 0.0 111.713 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.35 90.61 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.583 1.153 . . . . 0.0 112.708 -174.696 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.1 pt20 -75.49 151.98 37.93 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.022 -175.818 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -82.29 116.62 21.88 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 169.188 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.9 m -87.68 165.02 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.431 -0.793 . . . . 0.0 109.779 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.58 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -135.94 140.27 43.89 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.563 0.696 . . . . 0.0 112.034 -174.151 . . . . . . . . 3 3 . 1 . 007 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 25' ' ' LEU . 50.6 mt -116.81 156.01 27.98 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.609 1.564 . . . . 0.0 107.403 177.207 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.411 ' HB ' HG21 ' A' ' 22' ' ' VAL . 18.7 p -119.9 133.57 55.53 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.655 -0.653 . . . . 0.0 110.623 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.431 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 96.0 m-85 -135.54 147.67 48.85 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.886 1.275 . . . . 0.0 109.277 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 18.7 mm-40 -67.6 -24.62 65.51 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 123.601 0.563 . . . . 0.0 111.755 -174.409 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 76.1 p -134.44 163.13 30.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.398 0.679 . . . . 0.0 110.2 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -61.63 -39.5 91.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.471 0.708 . . . . 0.0 110.392 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -52.14 -44.62 64.65 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.747 1.279 . . . . 0.0 112.559 -176.263 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 51.4 mt-30 -70.97 -30.39 66.65 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.543 0.737 . . . . 0.0 111.976 -177.143 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.87 -38.61 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.306 0.643 . . . . 0.0 111.301 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -76.09 -39.02 56.27 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.82 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -30.68 71.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 111.695 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -64.42 -53.42 48.62 Favored 'General case' 0 C--N 1.354 0.803 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 174.899 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.43 -43.93 75.81 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.214 1.005 . . . . 0.0 111.724 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 -64.56 -44.57 90.33 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.35 1.06 . . . . 0.0 111.663 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -64.39 -28.78 69.92 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.757 0.823 . . . . 0.0 110.659 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -89.18 -16.84 30.4 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.451 0.7 . . . . 0.0 111.072 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.23 -7.49 81.44 Favored Glycine 0 C--N 1.35 1.335 0 C-N-CA 123.261 0.458 . . . . 0.0 112.89 -176.523 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.2 mt -59.35 112.01 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 123.233 0.613 . . . . 0.0 110.458 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -55.13 135.83 48.9 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.646 173.437 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -141.22 144.9 34.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.492 1.042 . . . . 0.0 112.505 -170.348 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 18.7 tpp180 -116.92 138.11 51.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.52 1.528 . . . . 0.0 108.298 170.515 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.485 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -105.06 133.34 49.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-O 121.113 0.482 . . . . 0.0 110.328 174.997 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.3 mp -104.12 112.26 36.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.1 mt -71.14 147.39 93.46 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.747 0.819 . . . . 0.0 111.328 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.411 ' HD2' ' HB2' ' A' ' 80' ' ' ALA . 98.5 Cg_endo -76.9 177.05 9.36 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.414 2.076 . . . . 0.0 111.889 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -27.75 69.31 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.621 0.768 . . . . 0.0 111.655 -179.393 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -97.6 13.95 28.33 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.644 1.177 . . . . 0.0 112.203 -174.118 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.411 ' HB2' ' HD2' ' A' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.478 0.974 0 C-N-CA 122.767 0.427 . . . . 0.0 111.384 176.653 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 p -135.38 102.53 5.18 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.2 138.61 38.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -167.058 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -107.23 122.04 45.74 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 175.082 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.507 HG13 HD23 ' A' ' 25' ' ' LEU . 4.3 mp -103.44 122.95 56.64 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.178 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -150.15 178.15 9.25 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.63 ' HB3' ' HG3' ' A' ' 77' ' ' PRO . 15.6 ttt180 -136.89 97.14 11.27 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -61.9 116.99 3.81 Favored 'Trans proline' 0 C--N 1.366 1.492 0 C-N-CA 122.913 2.409 . . . . 0.0 113.211 -165.554 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.21 -15.5 60.54 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.377 0.671 . . . . 0.0 110.649 171.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -70.6 -29.21 65.55 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.409 1.083 . . . . 0.0 111.117 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 73.7 p -78.52 137.3 37.85 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 172.994 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.64 -155.21 0.29 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.868 0.867 . . . . 0.0 110.129 175.905 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -54.79 -23.65 19.04 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.213 1.005 . . . . 0.0 112.933 177.315 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -72.08 89.0 1.12 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.704 0.802 . . . . 0.0 109.894 177.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.3 t -126.92 -4.26 6.37 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.261 1.024 . . . . 0.0 110.715 -177.457 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.2 35.62 60.51 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.893 -178.609 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.6 t -163.68 -162.27 0.71 Allowed 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 124.76 1.224 . . . . 0.0 108.534 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.57 170.54 3.93 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 118.231 0.469 . . . . 0.0 109.876 168.568 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -69.25 83.19 0.36 Allowed 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.665 0.745 . . . . 0.0 110.766 -174.318 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 t -164.78 136.93 4.48 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 114.605 -1.18 . . . . 0.0 108.565 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -68.31 132.05 46.42 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.177 0.591 . . . . 0.0 109.912 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.463 HG21 ' HB ' ' A' ' 54' ' ' THR . 14.1 p -82.54 156.91 3.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 176.491 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.426 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 67.8 m95 -88.72 131.86 34.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.099 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.5 t -101.14 139.88 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.244 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.507 HD23 HG13 ' A' ' 5' ' ' ILE . 3.2 tm? -114.64 104.35 11.9 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 105.828 -1.915 . . . . 0.0 105.828 174.563 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -113.35 131.73 55.85 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -143.04 154.98 44.53 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.597 0.759 . . . . 0.0 110.715 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -69.9 115.24 8.9 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 170.05 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.577 ' HB2' HG23 ' A' ' 51' ' ' VAL . . . -70.86 140.66 51.18 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.847 0.859 . . . . 0.0 111.382 -177.577 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -72.0 0.07 10.32 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.667 0.787 . . . . 0.0 112.807 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -70.57 128.32 91.18 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 123.682 0.793 . . . . 0.0 109.661 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -64.42 -163.17 0.05 OUTLIER 'Trans proline' 0 CA--C 1.551 1.366 0 C-N-CA 123.037 2.492 . . . . 0.0 113.16 170.108 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.62 ' HB3' ' HA ' ' A' ' 46' ' ' ASP . 6.0 ppt_? -65.07 -10.35 29.56 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 114.915 -1.038 . . . . 0.0 112.519 169.281 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -62.17 97.85 0.1 Allowed 'General case' 0 C--N 1.354 0.799 0 C-N-CA 124.4 1.08 . . . . 0.0 111.038 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.686 HG21 ' HA ' ' A' ' 41' ' ' TYR . 36.6 pt -84.58 166.99 1.97 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.922 176.951 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -83.02 126.14 73.22 Favored Pre-proline 0 CA--C 1.546 0.796 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 165.136 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -66.31 -2.66 7.46 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.574 2.182 . . . . 0.0 114.243 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.7 mm -59.99 -48.92 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 123.126 0.57 . . . . 0.0 109.712 165.135 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.4 ptm -107.49 179.8 4.14 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.481 -174.604 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -84.78 -172.57 49.24 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-N 115.73 -0.668 . . . . 0.0 113.468 -179.327 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.686 ' HA ' HG21 ' A' ' 35' ' ' ILE . 66.8 t80 -98.4 -33.55 11.0 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.025 0.93 . . . . 0.0 112.65 -173.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.9 t -63.14 -14.97 55.0 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -166.447 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.8 m -73.73 -24.42 59.9 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.135 0.574 . . . . 0.0 112.515 177.236 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.5 p -139.73 114.77 9.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.852 0.861 . . . . 0.0 109.794 178.502 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.1 t -81.65 -173.7 4.57 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.754 0.822 . . . . 0.0 110.7 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.62 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . 3.1 m-20 -57.02 -24.07 51.01 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.573 1.149 . . . . 0.0 113.412 -176.125 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -74.68 -77.41 0.12 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.407 0.283 . . . . 0.0 110.281 176.305 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 ptmt -179.8 -166.37 0.08 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.354 1.062 . . . . 0.0 109.304 -169.211 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -136.17 -173.98 3.55 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.671 0.789 . . . . 0.0 108.875 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -106.15 162.31 13.75 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.301 0.64 . . . . 0.0 110.246 176.054 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.577 HG23 ' HB2' ' A' ' 29' ' ' ALA . 46.3 t -137.71 147.0 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 124.975 1.31 . . . . 0.0 107.862 172.809 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 14.7 ptpt -144.0 139.01 28.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.588 0.708 . . . . 0.0 111.796 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.5 mt -118.47 157.79 26.58 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.469 1.507 . . . . 0.0 108.026 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.463 ' HB ' HG21 ' A' ' 22' ' ' VAL . 34.7 p -119.01 135.09 54.8 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.177 0.591 . . . . 0.0 109.956 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.54 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.9 m-85 -138.38 148.45 44.52 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.206 1.402 . . . . 0.0 109.787 -178.342 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 35.4 mt-10 -63.14 -32.98 74.49 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.353 0.661 . . . . 0.0 111.896 -174.631 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.9 p -134.65 164.12 28.22 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.658 0.783 . . . . 0.0 111.274 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.2 -46.1 86.42 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.137 173.96 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -48.42 -43.81 34.58 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 124.999 1.437 . . . . 0.0 112.811 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.54 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 26.9 mt-30 -70.12 -35.15 73.9 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.529 0.731 . . . . 0.0 111.774 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -76.84 -39.12 52.3 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.491 0.662 . . . . 0.0 110.653 -175.571 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -30.22 55.43 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.09 -36.0 76.42 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.296 0.639 . . . . 0.0 111.757 173.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -62.2 -58.44 7.76 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.58 -48.09 63.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.948 1.299 . . . . 0.0 112.423 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -61.06 -46.1 92.05 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.318 1.047 . . . . 0.0 111.392 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -59.56 -34.85 73.21 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.536 1.135 . . . . 0.0 111.242 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -87.66 -20.49 26.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.84 0.856 . . . . 0.0 111.587 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.57 -1.93 69.7 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 123.172 0.295 . . . . 0.0 113.143 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.8 mt -59.07 112.24 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.525 0.73 . . . . 0.0 110.939 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -58.0 138.1 56.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.281 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -146.71 148.84 32.41 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 118.719 0.69 . . . . 0.0 112.658 -172.964 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -114.18 122.96 48.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.007 1.323 . . . . 0.0 108.978 170.182 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.421 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -91.48 137.06 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.178 0.591 . . . . 0.0 110.007 173.283 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -122.15 137.18 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.776 1.63 . . . . 0.0 107.817 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.8 mt -95.25 137.69 22.08 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 122.756 0.423 . . . . 0.0 110.242 175.871 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.63 ' HG3' ' HB3' ' A' ' 7' ' ' ARG . 44.4 Cg_endo -85.38 -177.92 2.87 Favored 'Trans proline' 0 C--N 1.367 1.506 0 C-N-CA 123.652 2.901 . . . . 0.0 112.371 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.413 ' HD3' ' N ' ' A' ' 79' ' ' GLU . 0.1 OUTLIER -69.38 -33.52 73.17 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -176.118 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.413 ' N ' ' HD3' ' A' ' 78' ' ' LYS . 0.3 OUTLIER -96.91 -53.09 3.64 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.792 0.437 . . . . 0.0 110.995 -178.326 . . . . . . . . 3 3 . 1 . 008 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 C-N-CA 124.309 1.043 . . . . 0.0 112.612 -174.818 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.115 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 . . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.0 p -123.75 128.1 49.09 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.006 0.922 . . . . 0.0 110.129 -175.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.419 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -99.99 146.25 26.93 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -110.09 124.93 52.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.586 HG12 HD23 ' A' ' 25' ' ' LEU . 71.9 mt -98.41 129.76 48.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.686 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 173.235 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -152.15 -179.71 7.76 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.824 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.804 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 46.7 ttt180 -144.28 95.59 5.5 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 176.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -78.29 -170.22 0.93 Allowed 'Trans proline' 0 C--N 1.366 1.477 0 C-N-CA 123.082 2.521 . . . . 0.0 112.842 -163.735 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.433 ' HA ' ' HE2' ' A' ' 78' ' ' LYS . . . -78.29 -21.26 49.99 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.014 0.526 . . . . 0.0 110.998 173.846 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -148.42 124.01 10.43 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.113 0.965 . . . . 0.0 109.642 -175.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.1 p -96.24 -51.0 4.57 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.558 0.743 . . . . 0.0 111.252 -175.977 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.26 102.6 3.75 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.187 0.595 . . . . 0.0 110.274 -178.718 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.5 ptt? -94.99 -32.74 13.02 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.78 0.832 . . . . 0.0 112.227 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.99 132.98 47.5 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -172.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.3 t 66.56 -80.53 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.196 1.399 . . . . 0.0 111.493 175.555 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -81.55 77.32 2.06 Favored Glycine 0 C--N 1.348 1.247 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 177.032 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 43.2 p -73.52 85.72 1.55 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.829 0.852 . . . . 0.0 110.953 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.87 128.52 34.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.0 -177.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -82.44 -28.1 31.52 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.454 0.701 . . . . 0.0 110.537 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.3 p -77.27 95.54 4.37 Favored 'General case' 0 C--O 1.244 0.776 0 C-N-CA 123.6 0.76 . . . . 0.0 109.534 176.134 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -76.55 91.59 3.39 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 172.855 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.401 ' O ' ' HG3' ' A' ' 7' ' ' ARG . 31.5 m -98.5 -169.15 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 C-N-CA 124.986 1.315 . . . . 0.0 110.537 -177.576 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -86.62 136.7 32.95 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.448 0.699 . . . . 0.0 109.153 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.7 t -101.61 139.42 22.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.912 173.185 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.586 HD23 HG12 ' A' ' 5' ' ' ILE . 2.8 tm? -117.81 104.55 11.07 Favored 'General case' 0 C--N 1.343 0.326 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -107.47 134.32 50.68 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.628 -1.169 . . . . 0.0 107.886 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -141.52 149.97 41.56 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.651 0.78 . . . . 0.0 109.555 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -67.16 106.36 1.98 Allowed 'General case' 0 C--O 1.247 0.936 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.476 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.429 ' HB2' HG22 ' A' ' 51' ' ' VAL . . . -61.67 118.11 6.68 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 124.012 0.82 . . . . 0.0 109.55 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -84.52 39.06 0.71 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.174 0.989 . . . . 0.0 111.425 -176.776 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.5 p -53.63 131.45 55.36 Favored Pre-proline 0 CA--C 1.556 1.184 0 C-N-CA 124.174 0.99 . . . . 0.0 109.763 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.6 -164.04 0.09 OUTLIER 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 122.563 2.175 . . . . 0.0 113.084 -174.704 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -63.54 -27.26 69.14 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.322 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -82.1 88.17 6.45 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 170.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 37.9 mm -69.45 139.5 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 175.927 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -45.88 134.72 6.62 Favored Pre-proline 0 N--CA 1.491 1.599 0 C-N-CA 124.713 1.205 . . . . 0.0 111.779 -173.875 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -46.37 -47.14 15.74 Favored 'Trans proline' 0 C--N 1.386 2.509 0 C-N-CA 123.93 3.087 . . . . 0.0 113.375 -173.673 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.4 mt -47.92 -43.96 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.898 1.279 . . . . 0.0 112.223 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.9 ptm -118.57 21.99 12.28 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.759 0.823 . . . . 0.0 111.0 -175.48 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -160.4 51.36 0.36 Allowed Glycine 0 C--N 1.344 1.013 0 CA-C-N 116.699 -0.228 . . . . 0.0 113.126 -175.453 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -72.2 -37.74 69.19 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.979 0.512 . . . . 0.0 110.213 172.229 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.3 p -79.58 162.47 25.31 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.805 0.842 . . . . 0.0 111.604 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.5 m -71.81 -53.75 12.34 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.481 0.712 . . . . 0.0 109.458 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 24.1 m -80.3 77.95 7.02 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 170.23 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 22.7 p -92.43 -179.98 5.36 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.123 -175.24 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.91 160.72 31.32 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.527 0.731 . . . . 0.0 111.064 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.3 ptt? -71.61 -171.78 0.7 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.778 0.831 . . . . 0.0 111.417 -177.093 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.496 ' HD2' ' N ' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -82.61 91.17 6.9 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 174.226 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -68.54 166.09 17.76 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.048 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.1 pp0? -87.69 132.12 34.23 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 166.671 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.429 HG22 ' HB2' ' A' ' 29' ' ' ALA . 33.3 m -111.36 166.64 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 123.702 0.801 . . . . 0.0 109.093 169.436 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.6 pttt -144.87 155.88 43.7 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 121.597 0.713 . . . . 0.0 112.73 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.446 HD12 HD12 ' A' ' 25' ' ' LEU . 43.0 mt -125.39 160.4 29.48 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.74 1.616 . . . . 0.0 108.342 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 15.5 p -118.84 129.41 55.2 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.552 0.741 . . . . 0.0 109.795 172.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.15 147.31 50.55 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.79 1.636 . . . . 0.0 108.169 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -67.28 -31.36 71.62 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.615 0.766 . . . . 0.0 111.227 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 55.2 p -132.41 160.45 36.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.077 0.951 . . . . 0.0 110.112 -177.464 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -60.45 -40.87 92.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.375 0.67 . . . . 0.0 110.481 171.544 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -47.33 -47.21 25.82 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 124.497 1.123 . . . . 0.0 112.717 177.929 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.4 mt-30 -69.65 -31.03 68.87 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 122.967 0.507 . . . . 0.0 111.761 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.34 -42.99 34.53 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.561 0.744 . . . . 0.0 111.599 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -69.86 -42.68 73.18 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.894 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.65 -32.62 71.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.23 0.612 . . . . 0.0 111.474 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -64.68 -60.01 3.6 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 123.228 0.611 . . . . 0.0 109.533 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.94 -50.22 69.4 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.68 1.192 . . . . 0.0 112.332 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 56.2 mt-30 -59.57 -42.24 92.01 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.976 0.91 . . . . 0.0 111.566 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -62.22 -30.57 71.18 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.646 1.178 . . . . 0.0 110.931 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -87.88 -19.53 27.24 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.274 0.63 . . . . 0.0 111.058 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.04 -2.89 66.47 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 112.845 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 45.6 mt -67.14 108.56 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.172 0 CA-C-O 121.274 0.559 . . . . 0.0 110.537 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.44 140.77 57.08 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.845 171.524 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.419 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 34.5 p90 -142.31 151.63 42.16 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 118.633 0.651 . . . . 0.0 112.032 -169.394 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -120.42 115.49 23.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.247 1.019 . . . . 0.0 108.441 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -81.83 133.45 29.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.069 0.547 . . . . 0.0 111.1 177.723 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.02 136.9 51.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 125.721 1.608 . . . . 0.0 107.477 174.136 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.5 mt -71.34 147.62 93.05 Favored Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 123.214 0.606 . . . . 0.0 110.875 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.804 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 57.8 Cg_endo -73.29 175.07 11.07 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 122.969 2.446 . . . . 0.0 113.795 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.433 ' HE2' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -74.32 -22.32 59.31 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.153 172.439 . . . . . . . . 3 3 . 1 . 009 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.543 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 7.0 pt-20 -96.55 5.51 50.63 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.282 1.033 . . . . 0.0 111.551 -175.565 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.855 0 C-N-CA 123.078 0.551 . . . . 0.0 111.064 178.942 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' SER . . . . . 0.422 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 14.6 t -121.12 128.66 52.77 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.761 0.425 . . . . 0.0 111.257 -176.512 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.21 137.33 38.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.256 1.022 . . . . 0.0 110.394 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.55 119.98 41.09 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 108.042 175.113 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.0 mp -105.56 123.5 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 175.553 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.9 p90 -156.07 172.7 17.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.652 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.683 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 49.9 ttt180 -136.19 96.97 12.33 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.088 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.531 ' HG2' HG23 ' A' ' 11' ' ' THR . 78.3 Cg_endo -78.5 153.54 27.09 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 122.186 1.924 . . . . 0.0 112.217 -173.047 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.17 -12.98 61.48 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.963 0.905 . . . . 0.0 111.377 173.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -117.91 110.63 17.97 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.067 0.947 . . . . 0.0 110.62 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.531 HG23 ' HG2' ' A' ' 8' ' ' PRO . 16.6 p -146.19 -39.26 0.22 Allowed 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.04 1.336 . . . . 0.0 108.198 168.505 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 61.96 47.32 5.97 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.568 1.147 . . . . 0.0 111.396 172.983 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 81.2 mmm -84.19 136.5 33.94 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.144 -0.935 . . . . 0.0 108.703 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -129.18 92.43 3.38 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.34 0.656 . . . . 0.0 110.203 -176.913 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' SER . . . . . 0.401 ' OG ' HG22 ' A' ' 17' ' ' THR . 35.6 t -170.04 167.45 8.89 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.782 0.833 . . . . 0.0 109.655 172.274 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -75.38 -27.55 63.45 Favored Glycine 0 C--N 1.345 1.029 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 172.924 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.401 HG22 ' OG ' ' A' ' 15' ' ' SER . 12.4 t -83.35 -19.31 36.39 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.588 0.755 . . . . 0.0 110.94 176.435 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.55 111.06 19.39 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.571 0.748 . . . . 0.0 110.601 -173.315 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -62.21 143.31 56.98 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.596 0.759 . . . . 0.0 110.126 172.019 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.1 p -52.02 -35.94 48.57 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.118 0.967 . . . . 0.0 111.888 -176.793 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 21' ' ' ASN . . . . . 0.476 ' HA ' ' OG1' ' A' ' 11' ' ' THR . 12.7 m120 -120.56 126.54 50.58 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 124.806 1.242 . . . . 0.0 107.88 167.253 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 p -120.51 155.56 23.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 124.572 1.149 . . . . 0.0 108.865 -178.209 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -75.07 123.06 24.52 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 67.8 t -101.48 138.37 25.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 53' ' ' LEU . 52.4 tp -116.06 105.31 12.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 173.572 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.556 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 16.1 mt-10 -106.58 137.85 43.84 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 172.12 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -143.95 154.0 42.85 Favored 'General case' 0 CA--C 1.502 -0.875 0 CA-C-N 117.571 0.169 . . . . 0.0 110.779 177.736 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.8 102.86 0.5 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 164.792 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.3 123.41 13.72 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 123.855 0.722 . . . . 0.0 110.438 -175.473 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.8 3.08 3.48 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.039 0.936 . . . . 0.0 112.568 -175.654 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -88.32 132.26 39.86 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 124.155 0.982 . . . . 0.0 109.401 -179.684 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.43 -159.32 0.1 Allowed 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.907 2.405 . . . . 0.0 111.836 174.4 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -68.83 -14.71 63.2 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.703 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -75.36 87.23 2.55 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 123.331 0.653 . . . . 0.0 109.661 174.403 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.548 HD11 ' HA3' ' A' ' 40' ' ' GLY . 2.1 pp -124.54 -162.21 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 125.019 1.328 . . . . 0.0 108.928 176.358 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -62.28 117.6 31.85 Favored Pre-proline 0 N--CA 1.484 1.237 0 CA-C-N 118.285 0.493 . . . . 0.0 110.573 173.427 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.64 -5.36 12.87 Favored 'Trans proline' 0 C--N 1.383 2.342 0 C-N-CA 122.947 2.431 . . . . 0.0 113.342 -174.579 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.3 mt -59.77 -50.12 81.25 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 123.917 0.887 . . . . 0.0 110.111 168.562 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -105.2 8.67 34.11 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.006 0.922 . . . . 0.0 111.927 -172.78 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.548 ' HA3' HD11 ' A' ' 35' ' ' ILE . . . -173.58 -152.89 9.2 Favored Glycine 0 C--N 1.344 1.02 0 CA-C-O 119.832 -0.427 . . . . 0.0 113.004 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 23.3 t80 59.27 45.28 14.36 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.511 1.124 . . . . 0.0 110.168 -176.499 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.413 HG23 ' H ' ' A' ' 44' ' ' SER . 11.9 t -165.19 -150.43 0.13 Allowed 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 114.35 -1.295 . . . . 0.0 107.91 -175.69 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.0 t -54.5 -41.76 69.97 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 118.772 0.714 . . . . 0.0 110.52 171.257 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.413 ' H ' HG23 ' A' ' 42' ' ' THR . 35.6 t -70.45 107.07 3.66 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 167.257 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.6 t -148.77 89.69 1.71 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.461 0.704 . . . . 0.0 109.157 -174.884 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -80.11 140.47 36.41 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.186 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -65.06 -63.28 1.15 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 -178.73 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -175.11 128.67 0.29 Allowed 'General case' 0 C--O 1.241 0.611 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 176.192 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -89.48 -171.62 3.29 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 98.7 mt-30 -127.87 96.68 4.57 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.842 0.857 . . . . 0.0 108.906 174.295 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m -81.47 166.08 2.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 C-N-CA 123.659 0.784 . . . . 0.0 110.755 176.844 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.556 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 3.6 ptpp? -133.21 135.77 45.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.792 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.522 HD12 HD23 ' A' ' 25' ' ' LEU . 42.4 mt -117.47 142.91 46.59 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -114.68 128.95 56.59 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -134.56 156.64 48.31 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.254 1.022 . . . . 0.0 110.133 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -65.14 -31.3 72.42 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.001 0.813 . . . . 0.0 111.466 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 49.6 p -135.62 164.06 28.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.412 0.685 . . . . 0.0 110.965 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.89 -41.73 87.85 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.75 169.017 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -49.83 -45.74 50.54 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.922 1.389 . . . . 0.0 111.474 -174.343 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.1 mt-30 -72.19 -30.03 64.56 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.046 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.511 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -79.48 -40.59 29.4 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.227 0.611 . . . . 0.0 111.067 -176.912 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -70.78 -39.58 73.1 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.936 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.22 -36.77 66.32 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.739 0.816 . . . . 0.0 112.5 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -66.59 -55.91 13.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.019 0.528 . . . . 0.0 110.299 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.79 -47.09 64.36 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.437 1.095 . . . . 0.0 112.056 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -59.45 -45.24 92.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.091 0.956 . . . . 0.0 111.647 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.5 ttt180 -54.09 -39.39 66.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.737 1.215 . . . . 0.0 111.309 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.98 -27.0 36.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.434 0.694 . . . . 0.0 111.432 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 98.3 1.51 58.03 Favored Glycine 0 C--N 1.349 1.263 0 O-C-N 123.216 0.323 . . . . 0.0 112.592 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.9 mt -69.35 107.25 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 CA-C-O 121.403 0.621 . . . . 0.0 110.201 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.4 pt-20 -54.04 143.94 20.72 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.018 170.826 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -147.36 149.25 32.43 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.501 1.046 . . . . 0.0 113.026 -168.538 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -110.76 125.94 54.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.484 1.114 . . . . 0.0 109.928 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 92.4 t -89.89 118.59 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 173.777 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 77.1 mt -122.6 117.34 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.03 1.332 . . . . 0.0 108.444 -174.45 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 80.2 mt -71.0 147.53 93.93 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.045 0.938 . . . . 0.0 112.239 -174.273 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.683 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 86.5 Cg_endo -79.4 -179.33 5.3 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 123.375 2.717 . . . . 0.0 113.245 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -31.2 72.3 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.948 173.286 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -86.96 9.95 17.84 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.493 1.117 . . . . 0.0 111.696 -176.362 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.066 0 C-N-CA 122.82 0.448 . . . . 0.0 110.831 175.344 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.8 m -133.08 165.08 25.59 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -168.908 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.5 155.38 24.24 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 113.132 0.789 . . . . 0.0 113.132 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -113.05 123.73 50.97 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.062 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.444 HG12 ' HG ' ' A' ' 25' ' ' LEU . 89.9 mt -105.22 127.36 59.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 174.926 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -148.69 176.5 10.31 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 123.369 0.668 . . . . 0.0 109.434 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.51 ' HD3' ' HB3' ' A' ' 77' ' ' PRO . 34.1 ttt180 -140.72 95.72 7.77 Favored Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 173.806 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -82.05 179.52 5.51 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 122.968 2.446 . . . . 0.0 114.607 -163.924 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -86.93 -20.97 26.57 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.33 171.526 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.91 155.66 25.97 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.143 0.977 . . . . 0.0 109.564 174.329 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.0 t -168.62 -160.85 0.31 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -177.103 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.49 103.07 0.08 Allowed 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 169.778 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.445 ' HA ' ' OG1' ' A' ' 17' ' ' THR . 67.2 mtm -68.62 93.32 0.51 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.316 0.646 . . . . 0.0 110.674 -173.531 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -115.95 -63.04 1.51 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.992 0.917 . . . . 0.0 110.077 -174.565 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.6 p -137.46 97.23 3.41 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.922 0.889 . . . . 0.0 109.328 -175.237 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 73.14 -86.28 0.58 Allowed Glycine 0 C--N 1.344 1.005 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -171.09 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.445 ' OG1' ' HA ' ' A' ' 13' ' ' MET . 30.0 p 51.34 27.67 3.81 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 125.487 1.515 . . . . 0.0 114.381 167.261 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -151.4 -82.63 0.09 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.19 0.596 . . . . 0.0 110.389 177.499 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -72.06 -60.66 2.12 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.836 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.8 t -91.06 143.76 26.36 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 162.603 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -147.32 161.44 40.98 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -176.163 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.5 m -110.99 176.48 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.989 0.916 . . . . 0.0 108.764 171.293 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.4 m95 -86.64 125.93 34.17 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.3 t -100.52 136.23 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.444 ' HG ' HG12 ' A' ' 5' ' ' ILE . 5.5 tt -116.07 108.37 16.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 178.205 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -107.05 135.0 49.35 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 175.56 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.405 ' CE2' ' HA ' ' A' ' 29' ' ' ALA . 22.0 p90 -145.95 153.04 40.36 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -175.025 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -61.45 100.83 0.15 Allowed 'General case' 0 C--O 1.242 0.706 0 O-C-N 124.412 1.07 . . . . 0.0 108.483 163.832 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.405 ' HA ' ' CE2' ' A' ' 27' ' ' PHE . . . -53.15 140.41 26.02 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.897 1.279 . . . . 0.0 113.721 -168.931 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -85.99 26.67 0.97 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.211 1.004 . . . . 0.0 111.517 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -65.25 122.84 82.08 Favored Pre-proline 0 CA--C 1.557 1.227 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.72 -176.59 3.23 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.75 2.3 . . . . 0.0 113.197 -172.967 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -67.19 -14.66 63.12 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.51 177.933 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -77.29 30.41 0.14 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 124.109 0.964 . . . . 0.0 112.388 177.626 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 26.7 pt -61.76 122.01 11.4 Favored 'Isoleucine or valine' 0 C--N 1.357 0.933 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 169.517 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.467 ' HB3' ' O ' ' A' ' 39' ' ' MET . 16.6 t0 -67.89 127.35 93.34 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.916 -172.713 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 37' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 41' ' ' TYR . 19.0 Cg_endo -51.65 -27.11 24.89 Favored 'Trans proline' 0 C--N 1.377 2.036 0 C-N-CA 123.956 3.104 . . . . 0.0 113.055 177.943 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.1 mm -84.38 -53.46 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 123.368 0.667 . . . . 0.0 109.466 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.467 ' O ' ' HB3' ' A' ' 36' ' ' ASP . 65.1 mtt -131.35 103.17 6.3 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.638 0.775 . . . . 0.0 110.223 -176.651 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 135.35 -41.85 1.4 Allowed Glycine 0 N--CA 1.471 0.978 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' TYR . . . . . 0.45 ' HB3' ' HA ' ' A' ' 37' ' ' PRO . 59.3 t80 -107.87 99.29 8.77 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 175.249 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.411 ' OG1' ' HB2' ' A' ' 45' ' ' SER . 73.9 p -132.86 166.96 21.09 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.865 0.866 . . . . 0.0 109.675 176.917 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.5 t -64.67 -55.53 19.54 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.127 0.571 . . . . 0.0 110.179 177.8 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 58.1 m -82.68 84.41 7.31 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 173.025 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.411 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 22.3 t -164.15 -177.32 4.92 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 114.581 -1.19 . . . . 0.0 107.849 178.075 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -116.1 -178.14 3.33 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 177.187 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.9 ttt -62.31 -43.64 98.36 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.276 0.63 . . . . 0.0 109.46 166.491 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' N ' ' HD3' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -153.47 142.04 20.83 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.555 1.142 . . . . 0.0 108.948 175.989 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -78.01 179.94 6.48 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.616 0.767 . . . . 0.0 111.647 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -128.59 90.4 3.05 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.081 0.943 . . . . 0.0 108.535 173.788 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.4 p -93.06 165.96 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 C-N-CA 124.307 1.043 . . . . 0.0 110.16 -174.632 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -135.4 140.79 45.23 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.316 0.579 . . . . 0.0 111.833 -173.993 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.4 mp -120.47 153.12 37.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.988 1.315 . . . . 0.0 107.887 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.1 p -118.11 133.52 55.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.866 0.466 . . . . 0.0 110.634 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -133.84 147.18 51.17 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.108 1.363 . . . . 0.0 108.512 -177.5 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 30.7 mm-40 -71.07 -24.53 62.34 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -172.764 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 81.1 p -136.78 163.2 31.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.647 0.779 . . . . 0.0 109.736 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -64.51 -36.28 83.7 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.757 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -51.0 -48.93 61.25 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.912 0.885 . . . . 0.0 111.613 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.3 mt-30 -69.29 -29.36 67.22 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.319 -176.785 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.4 -41.51 32.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.17 0.588 . . . . 0.0 110.994 177.424 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.516 ' O ' ' HG3' ' A' ' 66' ' ' GLN . 13.0 pt-20 -77.43 -44.47 28.98 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.426 -169.991 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.14 69.02 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.414 1.086 . . . . 0.0 112.16 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -64.07 -54.7 29.99 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 172.319 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.5 -44.87 81.11 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.473 1.109 . . . . 0.0 111.944 178.774 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' GLN . . . . . 0.516 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 73.1 mt-30 -60.74 -44.28 96.87 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.105 0.962 . . . . 0.0 110.636 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -62.26 -31.07 71.59 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.005 1.322 . . . . 0.0 111.01 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -87.19 -22.16 25.46 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.051 0.94 . . . . 0.0 110.745 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.29 -1.31 72.96 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.704 -172.382 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.28 109.86 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-O 121.501 0.667 . . . . 0.0 110.357 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.17 133.94 53.87 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 113.793 -1.549 . . . . 0.0 108.102 171.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 55.7 p90 -140.38 152.68 45.95 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.611 -0.681 . . . . 0.0 110.927 -171.333 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 tpt85 -118.16 116.46 26.87 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 171.297 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.9 m -82.28 132.35 31.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-O 121.457 0.646 . . . . 0.0 110.69 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 mp -114.4 136.15 51.91 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.29 152.63 84.38 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 123.339 0.656 . . . . 0.0 111.863 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.51 ' HB3' ' HD3' ' A' ' 7' ' ' ARG . 37.2 Cg_endo -66.22 162.58 35.35 Favored 'Trans proline' 0 C--N 1.373 1.83 0 C-N-CA 122.437 2.091 . . . . 0.0 112.388 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.2 pttm -59.8 -30.58 69.0 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.163 0.585 . . . . 0.0 111.248 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -109.96 30.78 6.39 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.12 0.968 . . . . 0.0 110.28 -177.486 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.639 0 C-N-CA 123.327 0.651 . . . . 0.0 111.705 174.875 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.508 ' HG2' HG23 ' A' ' 70' ' ' ILE . 47.7 ttp . . . . . 0 N--CA 1.477 0.883 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -121.93 126.92 49.73 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.136 0.974 . . . . 0.0 109.299 -177.329 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.441 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -100.93 136.95 39.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.946 0.898 . . . . 0.0 109.738 -177.461 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -115.28 125.29 53.12 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 mp -105.37 121.82 57.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -147.62 172.3 14.25 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.393 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.656 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 38.7 ttt-85 -139.4 94.29 9.6 Favored Pre-proline 0 C--O 1.24 0.567 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 177.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.618 ' HB2' ' HG2' ' A' ' 10' ' ' LYS . 68.9 Cg_endo -86.67 154.22 8.88 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.866 2.378 . . . . 0.0 113.537 -168.987 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 9' ' ' ALA . . . . . 0.656 ' HB2' ' HG2' ' A' ' 78' ' ' LYS . . . -86.16 -13.57 46.64 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.161 0.984 . . . . 0.0 111.354 173.266 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.618 ' HG2' ' HB2' ' A' ' 8' ' ' PRO . 16.2 ptpt -77.93 -0.79 28.93 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.716 0.806 . . . . 0.0 111.551 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.565 HG23 ' HG2' ' A' ' 8' ' ' PRO . 18.3 p -54.64 143.66 24.16 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.732 0.813 . . . . 0.0 111.971 175.611 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.79 -172.58 3.92 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.761 0.824 . . . . 0.0 109.931 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.4 mtt 59.53 25.67 14.54 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.008 0.923 . . . . 0.0 111.972 172.727 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -75.18 99.63 4.05 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.148 0.579 . . . . 0.0 111.419 -174.15 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 t -105.75 -171.02 1.83 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.298 1.039 . . . . 0.0 109.089 174.208 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -75.56 74.4 1.52 Allowed Glycine 0 C--N 1.35 1.358 0 C-N-CA 122.65 0.166 . . . . 0.0 113.058 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.478 HG23 HG23 ' A' ' 20' ' ' THR . 7.8 t -162.11 152.77 17.39 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.6 1.16 . . . . 0.0 109.227 177.625 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.11 -17.33 52.87 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.259 0.624 . . . . 0.0 110.793 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -62.29 -23.09 66.52 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.556 1.142 . . . . 0.0 111.931 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.478 HG23 HG23 ' A' ' 17' ' ' THR . 42.7 p -48.11 -40.88 24.86 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 125.318 1.447 . . . . 0.0 113.284 -176.899 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.6 m-80 -85.54 92.47 8.54 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 172.983 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.9 p -88.82 151.51 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.145 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.422 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 77.1 m95 -77.5 116.05 17.76 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 177.178 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.509 HG22 HG22 ' A' ' 54' ' ' THR . 40.5 t -100.48 139.59 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.441 HD11 ' HB1' ' A' ' 3' ' ' ALA . 47.8 tp -116.24 106.08 13.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.246 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -114.94 133.14 56.26 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -144.59 154.38 42.78 Favored 'General case' 0 CA--C 1.505 -0.752 0 C-N-CA 123.807 0.843 . . . . 0.0 109.443 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.625 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 7.7 p-10 -84.25 123.46 30.16 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 170.484 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -93.57 114.39 26.72 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -171.383 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.472 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 8.4 pt-20 -75.16 64.3 1.4 Allowed 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 122.223 1.011 . . . . 0.0 110.369 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.9 p -115.4 127.0 27.17 Favored Pre-proline 0 CA--C 1.546 0.818 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -176.355 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.54 175.17 10.53 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.345 2.03 . . . . 0.0 112.064 178.969 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -69.93 -1.31 9.24 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.658 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -60.42 90.87 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.47 1.108 . . . . 0.0 111.179 173.901 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 65.3 mt -78.14 145.78 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 172.054 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -117.29 143.36 31.79 Favored Pre-proline 0 CA--C 1.544 0.733 0 CA-C-O 118.668 -0.682 . . . . 0.0 109.78 -174.154 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -49.76 -23.66 8.76 Favored 'Trans proline' 0 C--N 1.382 2.293 0 C-N-CA 123.864 3.043 . . . . 0.0 114.912 175.029 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.3 mt -75.7 -58.12 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 173.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 18.7 ptp -102.8 90.93 3.96 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.561 0.745 . . . . 0.0 109.68 -175.51 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -87.18 40.49 3.08 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 115.654 -0.703 . . . . 0.0 114.263 -173.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -78.7 99.47 6.64 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.968 0.507 . . . . 0.0 110.006 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 78.3 p -81.87 -12.14 58.6 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-O 121.377 0.608 . . . . 0.0 110.309 169.59 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.3 p -72.89 -8.4 55.43 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.564 1.146 . . . . 0.0 111.793 173.168 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 73.9 m -52.94 122.22 8.86 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.87 0.868 . . . . 0.0 110.798 172.477 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' SER . . . . . 0.638 ' HB3' ' SD ' ' A' ' 47' ' ' MET . 15.7 m -66.81 154.59 40.45 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.158 0.983 . . . . 0.0 112.288 -171.792 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -65.95 -39.47 90.48 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.455 0.702 . . . . 0.0 110.473 175.788 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' MET . . . . . 0.638 ' SD ' ' HB3' ' A' ' 45' ' ' SER . 1.6 pmm? -83.41 167.44 17.5 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.349 171.062 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.625 ' HG2' ' HB2' ' A' ' 28' ' ' ASP . 0.1 OUTLIER -63.4 99.19 0.19 Allowed 'General case' 0 CA--C 1.566 1.583 0 CA-C-O 121.802 0.81 . . . . 0.0 109.551 178.526 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -58.99 127.32 31.65 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.737 1.215 . . . . 0.0 112.758 -166.574 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.409 ' HA ' ' HA ' ' A' ' 28' ' ' ASP . 4.6 pm0 -85.69 91.64 8.35 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 121.727 0.775 . . . . 0.0 110.078 -177.763 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.9 m -89.61 163.91 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 123.757 0.823 . . . . 0.0 110.079 177.385 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -143.82 142.22 30.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.803 0.811 . . . . 0.0 112.28 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.31 159.96 23.96 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.324 1.85 . . . . 0.0 107.281 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.509 HG22 HG22 ' A' ' 24' ' ' VAL . 25.1 p -125.76 131.38 52.52 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.718 0.407 . . . . 0.0 110.743 177.349 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -129.44 153.61 47.77 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.176 1.391 . . . . 0.0 109.137 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -70.62 -25.56 63.08 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.008 0.523 . . . . 0.0 112.097 -176.185 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 71.3 p -134.15 162.56 31.79 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.986 0.422 . . . . 0.0 111.033 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -58.48 -44.56 89.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.863 170.293 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -54.22 -43.64 70.98 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.652 1.22 . . . . 0.0 112.207 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 56.6 mt-30 -71.07 -30.58 66.75 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.083 0.553 . . . . 0.0 111.813 -178.306 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -80.41 -38.54 30.04 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.299 0.571 . . . . 0.0 110.859 -177.034 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -76.34 -37.36 57.43 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.099 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.06 73.34 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.77 0.828 . . . . 0.0 111.722 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -65.8 -51.3 60.18 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.239 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.37 74.01 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.383 1.073 . . . . 0.0 111.515 175.302 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -63.65 -42.94 98.06 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.389 1.076 . . . . 0.0 111.63 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -55.77 -36.83 67.77 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.899 1.279 . . . . 0.0 110.735 175.554 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.425 ' HB2' HG13 ' A' ' 70' ' ' ILE . 35.0 mmtp -88.62 -19.21 26.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.458 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.27 -3.33 66.33 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-O 119.967 -0.352 . . . . 0.0 112.992 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.508 HG23 ' HG2' ' A' ' 1' ' ' MET . 22.1 mt -61.61 109.58 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 123.05 0.54 . . . . 0.0 109.569 -178.936 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.05 139.06 42.55 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 113.544 -1.662 . . . . 0.0 108.79 171.687 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -140.52 147.4 39.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.414 1.006 . . . . 0.0 112.005 -169.346 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -122.34 136.67 54.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.841 1.257 . . . . 0.0 108.439 169.101 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 m -105.69 138.23 31.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.131 0.572 . . . . 0.0 110.246 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.87 136.39 57.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.01 1.724 . . . . 0.0 107.029 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.467 ' HB3' ' HB2' ' A' ' 80' ' ' ALA . 85.6 mt -73.66 153.98 89.46 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 123.384 0.674 . . . . 0.0 111.345 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.656 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 30.6 Cg_endo -70.2 172.39 13.15 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 122.259 1.973 . . . . 0.0 111.984 177.525 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 78' ' ' LYS . . . . . 0.656 ' HG2' ' HB2' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -56.51 -24.17 44.57 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.307 1.043 . . . . 0.0 113.623 -172.924 . . . . . . . . 3 3 . 1 . 012 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.83 -46.07 3.55 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.086 0.554 . . . . 0.0 110.918 176.154 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.467 ' HB2' ' HB3' ' A' ' 76' ' ' LEU . . . . . . . . 0 N--CA 1.485 1.3 0 C-N-CA 125.097 1.359 . . . . 0.0 114.015 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.635 ' HA ' ' HB2' ' A' ' 28' ' ' ASP . 45.8 mtt . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.4 p -119.68 125.65 49.22 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.01 0.924 . . . . 0.0 110.399 -175.021 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.448 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -99.69 135.65 40.79 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.529 0.732 . . . . 0.0 109.948 -176.544 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -108.19 126.81 53.22 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.511 ' HB ' HG12 ' A' ' 74' ' ' VAL . 57.0 mt -107.32 120.98 59.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.625 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 173.972 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -144.86 173.1 12.15 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.468 ' HD3' ' HB3' ' A' ' 77' ' ' PRO . 59.9 ttt180 -141.38 94.38 7.62 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.371 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -91.7 161.24 3.47 Favored 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 123.365 2.71 . . . . 0.0 113.021 -169.964 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.22 -30.76 48.98 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.152 172.366 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -135.74 145.02 46.18 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.875 0.87 . . . . 0.0 110.247 177.124 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.6 t -175.93 -170.88 0.41 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.444 1.098 . . . . 0.0 108.439 -173.887 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 103.75 0.42 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 165.236 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -82.89 39.39 0.63 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.298 1.039 . . . . 0.0 111.695 -173.439 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -123.33 164.41 18.86 Favored 'General case' 0 C--O 1.245 0.834 0 C-N-CA 124.845 1.258 . . . . 0.0 108.962 176.871 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.7 m 69.38 -69.28 0.17 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 125.152 1.381 . . . . 0.0 110.487 -176.848 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -87.71 66.04 3.45 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 116.638 -0.256 . . . . 0.0 112.881 176.077 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 31.0 p -92.2 54.27 2.32 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.628 0.771 . . . . 0.0 110.021 177.571 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.96 168.82 16.65 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.516 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -61.77 -42.1 98.55 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.246 0.618 . . . . 0.0 110.519 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.6 p -100.78 167.08 10.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.128 0.971 . . . . 0.0 110.083 173.637 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -66.04 139.04 58.17 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 168.404 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.403 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 20.9 m -113.1 175.18 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.334 0.654 . . . . 0.0 110.351 -178.82 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -85.15 121.71 28.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -177.433 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.507 HG22 HG22 ' A' ' 54' ' ' THR . 53.1 t -100.21 136.53 31.18 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.448 HD11 ' HB1' ' A' ' 3' ' ' ALA . 56.2 tp -116.77 106.28 13.31 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.878 1.271 . . . . 0.0 108.336 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -112.38 133.7 54.33 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.439 ' CE2' ' HA ' ' A' ' 29' ' ' ALA . 12.4 p90 -145.85 155.98 43.26 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 118.372 0.533 . . . . 0.0 110.87 -177.34 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.635 ' HB2' ' HA ' ' A' ' 1' ' ' MET . 3.6 m-20 -61.52 97.94 0.08 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 167.343 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.469 ' HB2' HG22 ' A' ' 51' ' ' VAL . . . -67.81 139.91 56.61 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 123.882 0.738 . . . . 0.0 110.749 -171.083 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -75.09 64.39 1.38 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 122.234 1.016 . . . . 0.0 110.64 -179.148 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.0 p -147.85 119.26 4.49 Favored Pre-proline 0 CA--C 1.549 0.918 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 -176.381 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.402 ' O ' HG23 ' A' ' 35' ' ' ILE . 83.4 Cg_endo -77.83 -156.03 0.06 OUTLIER 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 122.639 2.226 . . . . 0.0 111.438 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -21.77 20.42 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.322 0.649 . . . . 0.0 112.048 172.312 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -77.88 72.4 4.41 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.919 0.888 . . . . 0.0 108.917 173.26 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.402 HG23 ' O ' ' A' ' 32' ' ' PRO . 2.6 pp -96.03 -171.57 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.747 0.819 . . . . 0.0 109.979 177.837 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -60.1 122.01 63.23 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 123.342 0.657 . . . . 0.0 111.502 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.58 -10.13 26.79 Favored 'Trans proline' 0 C--N 1.382 2.326 0 C-N-CA 122.806 2.337 . . . . 0.0 112.774 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.0 mm -56.42 -42.91 76.27 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 124.472 1.109 . . . . 0.0 110.163 172.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 53.8 mtm -120.66 28.11 8.15 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.283 1.033 . . . . 0.0 109.744 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -85.94 -2.21 86.39 Favored Glycine 0 C--N 1.347 1.152 0 N-CA-C 114.968 0.747 . . . . 0.0 114.968 -171.661 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -72.91 83.02 1.21 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 117.69 0.745 . . . . 0.0 110.062 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 3.6 t -173.24 115.73 0.26 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.688 1.195 . . . . 0.0 108.097 -179.151 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.1 m -59.38 -47.71 84.39 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.229 0.612 . . . . 0.0 111.345 -175.621 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 42.7 t -100.47 97.59 8.3 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 24.8 m -82.98 -178.74 7.23 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.672 0.789 . . . . 0.0 110.741 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -66.35 131.52 46.27 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.924 0.49 . . . . 0.0 110.078 175.003 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -61.57 -38.12 86.34 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 170.16 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.58 132.55 9.7 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 169.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -96.99 116.11 28.63 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.767 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.406 ' HA ' ' O ' ' A' ' 27' ' ' PHE . 2.2 mp0 -71.32 91.33 0.98 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.272 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.469 HG22 ' HB2' ' A' ' 29' ' ' ALA . 22.2 m -88.85 168.52 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.152 0.981 . . . . 0.0 109.879 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -137.55 147.69 45.34 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.927 0.87 . . . . 0.0 112.309 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.94 156.69 29.11 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 113.721 -1.581 . . . . 0.0 107.136 176.591 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.507 HG22 HG22 ' A' ' 24' ' ' VAL . 12.2 p -122.76 128.6 50.69 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.419 0.554 . . . . 0.0 110.372 176.31 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.403 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 97.9 m-85 -128.62 152.15 48.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.379 1.472 . . . . 0.0 108.534 -178.248 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 49.1 mm-40 -65.96 -33.63 76.27 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.888 0.375 . . . . 0.0 111.302 -179.091 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 65.1 p -134.33 159.32 41.37 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.52 0.728 . . . . 0.0 110.694 -173.686 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -58.45 -44.84 89.35 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.54 1.136 . . . . 0.0 111.419 174.243 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -50.36 -43.11 54.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.322 . . . . 0.0 112.798 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 55.1 mt-30 -70.99 -31.68 68.29 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.013 0.525 . . . . 0.0 111.964 179.751 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.53 -40.31 57.16 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.78 0.432 . . . . 0.0 111.088 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -72.45 -33.87 67.35 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.773 177.632 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.2 -41.25 75.29 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.08 0.552 . . . . 0.0 111.427 173.763 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -67.08 -58.79 4.22 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 123.314 0.645 . . . . 0.0 110.387 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -50.85 -51.48 50.95 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.79 1.236 . . . . 0.0 112.744 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -63.6 -40.02 95.86 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.698 0.799 . . . . 0.0 111.816 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -54.45 -37.15 64.85 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.615 1.166 . . . . 0.0 110.855 174.289 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.548 ' HB2' HG13 ' A' ' 70' ' ' ILE . 33.0 mmtp -90.43 -20.06 23.19 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.497 0.719 . . . . 0.0 111.686 -178.441 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.57 1.86 60.28 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-O 119.891 -0.394 . . . . 0.0 113.14 -176.406 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.548 HG13 ' HB2' ' A' ' 68' ' ' LYS . 10.7 mt -64.25 108.71 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-O 120.956 0.408 . . . . 0.0 110.439 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -56.43 139.2 49.78 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.152 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -148.14 153.09 38.37 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.794 0.724 . . . . 0.0 111.179 -170.408 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' ARG . . . . . 0.43 ' NH1' HG13 ' A' ' 75' ' ' ILE . 6.2 tmm_? -133.92 146.81 50.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 169.539 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.511 HG12 ' HB ' ' A' ' 5' ' ' ILE . 19.8 m -106.36 140.91 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.746 0.784 . . . . 0.0 111.747 -173.834 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.43 HG13 ' NH1' ' A' ' 73' ' ' ARG . 3.3 mp -109.35 141.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 125.803 1.641 . . . . 0.0 107.088 173.517 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.6 mt -65.42 151.21 94.72 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 122.761 0.424 . . . . 0.0 111.531 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.468 ' HB3' ' HD3' ' A' ' 7' ' ' ARG . 40.6 Cg_endo -67.34 169.78 14.77 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 122.662 2.242 . . . . 0.0 114.049 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.09 -20.63 63.19 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.361 175.7 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.447 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 1.0 OUTLIER -100.49 8.95 43.21 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.276 1.03 . . . . 0.0 111.683 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.943 0 C-N-CA 123.419 0.688 . . . . 0.0 109.628 173.714 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.5 mtm . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 p -135.61 106.79 6.75 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 -176.647 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.63 137.12 39.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.909 0.484 . . . . 0.0 111.189 -166.112 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.85 132.11 54.45 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.827 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 58' ' ' GLN . 40.2 mt -112.57 123.98 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.667 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.45 175.29 12.0 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.77 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 40.7 ttt-85 -136.74 97.17 11.45 Favored Pre-proline 0 N--CA 1.479 0.992 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.258 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -78.68 167.65 22.19 Favored 'Trans proline' 0 C--N 1.371 1.717 0 C-N-CA 123.253 2.635 . . . . 0.0 112.638 -170.745 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.11 -36.32 72.1 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.255 0.622 . . . . 0.0 110.658 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.84 121.33 41.21 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 171.307 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.8 m -123.04 123.03 39.95 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.747 1.219 . . . . 0.0 109.358 -174.567 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.14 148.79 32.22 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.712 0.405 . . . . 0.0 110.316 177.357 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.02 121.14 33.31 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -81.75 -34.43 30.45 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.065 0.546 . . . . 0.0 110.126 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.0 t -153.5 57.07 0.76 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 121.496 0.665 . . . . 0.0 109.25 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.81 33.94 88.57 Favored Glycine 0 C--N 1.349 1.3 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.909 -175.344 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.0 p -104.4 21.79 16.05 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.428 1.091 . . . . 0.0 112.734 -168.411 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -140.87 88.4 2.18 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 120.745 0.307 . . . . 0.0 110.722 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -81.73 -41.02 21.86 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.339 0.656 . . . . 0.0 109.592 172.044 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.5 p -134.21 -80.42 0.46 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.309 1.043 . . . . 0.0 108.399 174.796 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -146.14 131.51 18.6 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.968 0.907 . . . . 0.0 109.323 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.445 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 16.8 m -122.66 176.47 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 166.79 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -86.94 130.32 34.51 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -177.11 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.1 t -101.29 137.54 28.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 54.2 tp -115.27 105.09 12.47 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 177.377 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -118.58 130.17 55.74 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.441 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -138.59 155.34 48.42 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 118.401 0.546 . . . . 0.0 111.561 -173.875 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.34 94.89 0.18 Allowed 'General case' 0 C--O 1.237 0.438 0 O-C-N 124.092 0.87 . . . . 0.0 109.868 168.892 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.563 ' HB3' ' HG3' ' A' ' 49' ' ' GLN . . . -74.92 99.99 3.98 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.196 179.431 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.514 ' HA ' ' HG3' ' A' ' 48' ' ' LYS . 10.0 pt-20 -67.77 96.28 0.56 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.722 -178.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.5 p -111.19 99.49 43.61 Favored Pre-proline 0 CA--C 1.554 1.114 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.178 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -83.32 -144.13 0.03 OUTLIER 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 123.133 2.555 . . . . 0.0 110.563 171.946 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -4.14 0.15 Allowed 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -59.38 -6.9 1.12 Allowed 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.21 1.004 . . . . 0.0 113.649 174.132 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.414 HD12 ' O ' ' A' ' 35' ' ' ILE . 1.9 pp -54.95 98.55 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.127 0 CA-C-O 121.564 0.697 . . . . 0.0 109.367 165.674 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -56.1 133.91 74.56 Favored Pre-proline 0 N--CA 1.476 0.845 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.775 -170.343 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.13 -14.81 15.93 Favored 'Trans proline' 0 C--N 1.382 2.311 0 C-N-CA 123.142 2.561 . . . . 0.0 112.936 172.773 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.4 mm -60.39 -39.76 82.0 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 C-N-CA 124.086 0.954 . . . . 0.0 110.246 171.412 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 78.7 mtp -113.88 97.14 6.21 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.149 0.979 . . . . 0.0 109.136 173.838 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.66 99.8 0.24 Allowed Glycine 0 C--N 1.348 1.246 0 O-C-N 123.352 0.408 . . . . 0.0 113.019 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -128.86 15.01 6.39 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.842 0.857 . . . . 0.0 110.07 -178.121 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.4 p -69.95 -8.76 51.55 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.76 0.824 . . . . 0.0 112.961 -175.762 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.0 m -71.47 -18.3 62.31 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.612 0.765 . . . . 0.0 111.867 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.8 m -143.66 104.59 4.22 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 123.387 0.675 . . . . 0.0 110.554 177.941 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 t -94.37 88.29 5.48 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 171.803 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -81.0 145.55 31.12 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.455 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -73.77 89.84 1.83 Allowed 'General case' 0 C--O 1.246 0.875 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.651 179.294 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HG3' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER 61.38 -170.57 0.16 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.93 1.292 . . . . 0.0 111.797 177.143 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 49' ' ' GLN . . . . . 0.563 ' HG3' ' HB3' ' A' ' 29' ' ' ALA . 12.7 pt20 -151.39 -170.57 3.69 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.174 0.99 . . . . 0.0 108.335 173.765 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -140.06 113.99 8.88 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 173.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.414 HG22 ' HB2' ' A' ' 29' ' ' ALA . 29.8 m -108.66 166.49 4.46 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 C-N-CA 124.016 0.927 . . . . 0.0 109.491 172.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.61 150.48 37.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.336 1.065 . . . . 0.0 113.361 -173.056 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -121.68 159.15 27.14 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 113.532 -1.667 . . . . 0.0 107.599 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 p -122.28 129.87 52.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.081 0.953 . . . . 0.0 110.309 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.462 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 94.9 m-85 -130.54 148.93 52.4 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.268 1.427 . . . . 0.0 108.171 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.99 -29.65 70.07 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 120.906 0.384 . . . . 0.0 110.477 -176.066 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.8 p -133.07 159.66 39.44 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.2 1.0 . . . . 0.0 110.134 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.472 ' HG3' HG21 ' A' ' 5' ' ' ILE . 41.0 tt0 -59.99 -41.17 91.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.7 0.8 . . . . 0.0 110.864 171.871 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -50.48 -45.57 56.37 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 124.559 1.162 . . . . 0.0 112.201 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.462 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 53.5 mt-30 -67.32 -32.54 73.57 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.178 0.591 . . . . 0.0 111.385 -178.571 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.18 -42.95 54.73 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.058 0.543 . . . . 0.0 111.459 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -75.08 -39.22 60.94 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.844 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.29 71.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.518 0.727 . . . . 0.0 111.661 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 64' ' ' TYR . . . . . 0.507 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 14.9 t80 -66.91 -56.64 9.39 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.942 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.83 -45.66 70.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.086 0.954 . . . . 0.0 112.529 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 52.3 mt-30 -62.03 -43.93 97.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.487 1.115 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -57.23 -34.52 68.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.703 1.201 . . . . 0.0 111.646 176.972 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.63 ' HB2' HG13 ' A' ' 70' ' ' ILE . 11.7 mmmm -92.22 -16.88 25.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.13 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 88.48 1.5 80.85 Favored Glycine 0 C--N 1.35 1.35 0 O-C-N 123.616 0.573 . . . . 0.0 112.849 -173.533 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.63 HG13 ' HB2' ' A' ' 68' ' ' LYS . 73.0 mt -57.95 114.94 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.259 0.623 . . . . 0.0 110.988 -179.247 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -57.61 131.2 49.51 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 113.942 -1.481 . . . . 0.0 108.543 169.692 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.7 p90 -144.01 147.97 34.61 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-O 121.272 0.558 . . . . 0.0 111.43 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -117.6 123.06 45.26 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.343 172.225 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.9 t -80.19 124.2 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 170.309 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -107.87 120.44 59.23 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 169.417 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.3 mt -58.8 149.36 64.59 Favored Pre-proline 0 CA--C 1.544 0.748 0 O-C-N 123.185 0.303 . . . . 0.0 110.28 176.662 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.77 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 40.7 Cg_endo -65.51 163.25 30.59 Favored 'Trans proline' 0 C--N 1.363 1.306 0 C-N-CA 122.252 1.968 . . . . 0.0 112.233 -177.945 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -30.47 62.6 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.078 0.951 . . . . 0.0 111.306 178.203 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.43 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 6.8 pt-20 -76.76 -24.22 52.95 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.402 1.081 . . . . 0.0 111.462 -175.313 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.995 0 C-N-CA 123.517 0.727 . . . . 0.0 112.329 -175.555 . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 m -116.62 116.9 28.44 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -171.142 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.456 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -100.89 123.79 45.61 Favored 'General case' 0 C--O 1.218 -0.589 0 C-N-CA 123.146 0.578 . . . . 0.0 109.899 -172.069 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -107.18 119.26 38.91 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 91.5 mt -105.09 121.19 56.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.439 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.7 p90 -152.15 177.49 10.47 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.534 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 21.7 ttt180 -143.52 97.5 5.52 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.623 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -64.71 132.55 33.2 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 122.675 2.25 . . . . 0.0 112.085 -174.913 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.53 -33.86 74.54 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.649 0.779 . . . . 0.0 110.525 173.616 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -152.13 149.31 28.65 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.8 t -156.18 176.25 12.91 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 122.846 0.458 . . . . 0.0 111.001 -169.643 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.13 -0.02 57.62 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.866 0.866 . . . . 0.0 111.56 177.014 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.1 mmt -65.18 94.31 0.15 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.274 0.63 . . . . 0.0 110.324 178.232 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -77.01 102.42 6.44 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.634 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.8 t -158.5 -174.2 4.67 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.346 0.658 . . . . 0.0 109.903 -171.811 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -85.35 35.36 3.17 Favored Glycine 0 C--N 1.351 1.402 0 CA-C-N 116.811 -0.177 . . . . 0.0 113.177 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.4 p -88.86 78.28 7.61 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.512 0.725 . . . . 0.0 109.899 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.78 122.3 34.19 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.742 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.1 tttt 68.42 -72.9 0.09 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.18 1.392 . . . . 0.0 111.185 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 p -75.02 129.86 38.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.856 0.462 . . . . 0.0 110.466 177.644 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -87.49 -176.87 5.75 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.341 1.056 . . . . 0.0 111.127 -175.028 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.4 p -131.42 156.24 42.49 Favored 'Isoleucine or valine' 0 C--O 1.246 0.914 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.56 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -85.3 133.39 34.15 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.3 t -102.31 137.24 30.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.201 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 2.8 tt -115.72 106.61 14.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 175.643 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -116.89 131.17 57.02 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 -177.52 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.456 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 43.1 p90 -145.76 158.79 43.83 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.334 0.654 . . . . 0.0 110.522 179.583 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -54.21 105.41 0.14 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 114.378 -1.283 . . . . 0.0 108.284 170.51 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -40.44 122.57 1.62 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.719 1.208 . . . . 0.0 112.304 -177.778 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -70.47 76.79 0.57 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 122.344 1.068 . . . . 0.0 110.67 -178.085 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.8 p -148.42 134.14 9.6 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.54 -178.746 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.21 -168.78 0.22 Allowed 'Trans proline' 0 C--N 1.372 1.804 0 C-N-CA 122.491 2.127 . . . . 0.0 111.883 173.295 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.77 3.09 3.46 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -70.44 75.77 0.56 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.33 1.052 . . . . 0.0 109.2 169.035 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 23.3 pt -125.06 165.91 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 124.848 1.259 . . . . 0.0 108.894 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -67.6 117.85 51.5 Favored Pre-proline 0 CA--C 1.544 0.734 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 175.401 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.06 -18.35 57.41 Favored 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 122.543 2.162 . . . . 0.0 112.179 173.378 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.9 mm -64.19 -46.38 93.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 124.172 0.989 . . . . 0.0 110.812 174.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 70.5 mtm -114.27 15.2 18.14 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.616 0.766 . . . . 0.0 111.073 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.483 ' HA2' ' HB2' ' A' ' 44' ' ' SER . . . -86.17 46.88 3.67 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 116.249 -0.432 . . . . 0.0 113.389 -175.82 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -161.13 -37.68 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.9 0.88 . . . . 0.0 109.528 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 18.7 p -83.54 -71.92 0.48 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.765 0.826 . . . . 0.0 110.597 176.114 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -71.58 -44.11 65.09 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.793 0.837 . . . . 0.0 110.415 -177.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' SER . . . . . 0.483 ' HB2' ' HA2' ' A' ' 40' ' ' GLY . 18.4 m -107.08 82.46 1.69 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 175.568 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.3 m -66.78 -23.63 66.09 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.711 0.805 . . . . 0.0 111.82 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -129.7 -150.97 0.45 Allowed 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.041 0.937 . . . . 0.0 109.348 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 52.5 ttm -51.91 -27.57 13.42 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.343 1.057 . . . . 0.0 112.891 176.536 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 pttp -149.96 -172.04 4.06 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.883 0.873 . . . . 0.0 110.309 -166.233 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -124.61 -160.01 0.91 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.786 0.834 . . . . 0.0 108.828 175.866 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -104.8 154.75 19.62 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 121.049 0.452 . . . . 0.0 110.34 174.192 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.6 p -139.01 142.85 32.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.035 0.934 . . . . 0.0 108.951 174.332 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 14.5 ptpt -137.75 133.11 33.72 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.592 0.711 . . . . 0.0 112.233 -175.833 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.4 mp -119.45 151.09 39.13 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.191 1.396 . . . . 0.0 107.652 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.2 p -118.26 132.54 56.3 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 118.564 0.62 . . . . 0.0 111.243 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -132.7 149.53 52.28 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.247 1.419 . . . . 0.0 108.938 -177.787 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 40.3 mt-10 -68.91 -28.19 66.45 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.936 0.494 . . . . 0.0 111.901 -176.138 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.0 p -134.64 162.14 33.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.442 0.697 . . . . 0.0 110.909 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.74 -43.0 98.46 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.622 0.769 . . . . 0.0 111.011 171.857 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -57.1 -37.5 72.03 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.225 0.953 . . . . 0.0 111.779 -175.562 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 57.1 mt-30 -72.91 -32.81 65.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.999 0.52 . . . . 0.0 111.442 178.14 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.73 -39.06 57.88 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 -177.301 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.11 -32.29 63.15 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.952 176.915 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.67 -37.91 66.33 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.359 0.663 . . . . 0.0 111.693 174.175 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -65.34 -59.78 3.67 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.643 0.777 . . . . 0.0 110.416 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.88 70.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.394 1.077 . . . . 0.0 112.767 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 57.7 mt-30 -63.01 -39.71 95.56 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.162 0.985 . . . . 0.0 111.287 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -53.82 -38.22 64.38 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.316 1.046 . . . . 0.0 111.322 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' LYS . . . . . 0.461 ' HB2' HG13 ' A' ' 70' ' ' ILE . 79.7 mttt -93.27 -18.03 22.94 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.921 -176.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.69 6.76 76.19 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.195 -172.635 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.461 HG13 ' HB2' ' A' ' 68' ' ' LYS . 67.7 mt -60.5 113.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -56.62 129.97 43.26 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.111 -1.858 . . . . 0.0 108.666 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -141.17 140.23 34.0 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.692 -0.63 . . . . 0.0 111.746 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.2 tpp85 -104.74 122.99 46.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.692 1.197 . . . . 0.0 108.937 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.1 t -85.12 125.88 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.439 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.7 mp -108.41 125.35 65.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 C-N-CA 125.397 1.479 . . . . 0.0 107.107 170.205 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.7 mt -78.26 141.12 61.62 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 122.288 0.235 . . . . 0.0 111.092 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.534 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 67.9 Cg_endo -83.69 -169.7 0.74 Allowed 'Trans proline' 0 C--N 1.366 1.469 0 C-N-CA 123.464 2.776 . . . . 0.0 112.913 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -12.78 61.36 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.853 0.861 . . . . 0.0 112.364 179.134 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 79' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 80' ' ' ALA . 6.9 pt-20 -109.02 -65.1 1.17 Allowed 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.08 0.952 . . . . 0.0 110.037 -177.659 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.464 ' H ' ' HG2' ' A' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.481 1.083 0 C-N-CA 125.578 1.551 . . . . 0.0 113.025 172.554 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.457 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.9 OUTLIER . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 . . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.2 p -134.18 95.74 3.48 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -167.439 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.469 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -98.02 145.07 26.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.055 -172.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -113.84 125.28 53.9 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 168.122 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.519 ' HB ' HG12 ' A' ' 74' ' ' VAL . 91.6 mt -107.07 121.49 59.98 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.452 ' HA ' ' O ' ' A' ' 75' ' ' ILE . 30.5 p90 -149.1 174.91 11.82 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -126.26 99.95 30.27 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 175.535 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 72.3 Cg_endo -70.01 126.65 13.38 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 123.022 2.481 . . . . 0.0 112.865 -172.501 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.51 -47.52 60.06 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.648 0.779 . . . . 0.0 109.1 170.263 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -90.2 117.32 28.86 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 170.435 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.2 t -158.21 165.3 35.23 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.48 0.712 . . . . 0.0 110.237 -176.734 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.67 100.28 0.52 Allowed 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.4 ptp -63.18 127.75 32.69 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.475 0.71 . . . . 0.0 110.811 -175.112 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.6 tm0? -65.11 -59.95 3.56 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 175.059 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.0 t -178.68 -49.24 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.373 1.069 . . . . 0.0 108.814 177.937 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 136.9 -24.32 3.15 Favored Glycine 0 N--CA 1.473 1.128 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.645 -177.14 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.4 t -67.02 -32.12 73.13 Favored 'General case' 0 CA--C 1.55 0.981 0 C-N-CA 123.408 0.683 . . . . 0.0 111.19 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.69 179.29 5.41 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.604 0.762 . . . . 0.0 109.75 171.28 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 19' ' ' LYS . . . . . 0.599 ' HE2' HG12 ' A' ' 22' ' ' VAL . 34.5 mtmm -65.99 -27.73 68.36 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -173.614 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 64.4 p 60.58 -69.74 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 126.286 1.834 . . . . 0.0 112.42 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -72.93 88.77 1.38 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 171.376 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.599 HG12 ' HE2' ' A' ' 19' ' ' LYS . 27.0 m -107.39 175.33 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 172.661 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -87.96 125.89 34.76 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 118.819 0.736 . . . . 0.0 109.448 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 76.1 t -101.39 138.97 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.412 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 9.4 tt -115.22 107.21 14.99 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -116.37 130.4 56.75 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.468 ' O ' ' HA ' ' A' ' 50' ' ' GLN . 45.1 p90 -141.09 154.39 45.9 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 -175.955 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.09 128.29 37.88 Favored 'General case' 0 C--O 1.241 0.643 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 169.785 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.25 159.44 25.9 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.678 0.751 . . . . 0.0 111.805 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.58 7.93 7.39 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 114.177 -1.374 . . . . 0.0 111.622 178.553 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.583 ' HB ' ' HG2' ' A' ' 48' ' ' LYS . 9.3 p -47.59 127.66 10.56 Favored Pre-proline 0 CA--C 1.564 1.487 0 C-N-CA 123.872 0.869 . . . . 0.0 112.384 174.323 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.81 170.37 18.92 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.652 2.235 . . . . 0.0 111.991 175.767 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -62.93 -26.82 68.99 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.854 175.588 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -78.1 99.09 6.02 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.629 0.772 . . . . 0.0 109.897 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 10.9 pt -123.7 179.74 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 124.319 1.048 . . . . 0.0 110.237 -179.111 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -60.26 123.15 71.74 Favored Pre-proline 0 N--CA 1.482 1.163 0 C-N-CA 123.109 0.564 . . . . 0.0 111.239 -177.404 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -55.17 -26.07 49.26 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 124.028 3.152 . . . . 0.0 114.044 176.817 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.4 mt -81.86 -82.55 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 123.113 0.565 . . . . 0.0 110.563 -173.305 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 24.9 ptm -92.95 4.29 54.23 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.808 0.443 . . . . 0.0 112.079 -173.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.93 -13.51 61.78 Favored Glycine 0 N--CA 1.478 1.477 0 N-CA-C 113.869 0.307 . . . . 0.0 113.869 177.92 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -56.42 -36.42 68.94 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.652 0.781 . . . . 0.0 110.347 171.126 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 16.7 p -111.78 99.65 8.31 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.371 1.068 . . . . 0.0 108.672 171.686 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.1 t -63.6 -15.45 58.2 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.221 1.009 . . . . 0.0 112.41 -174.891 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.1 t -65.53 85.79 0.07 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.718 0.807 . . . . 0.0 110.713 176.213 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.6 m -147.51 -173.8 4.36 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.774 0.83 . . . . 0.0 110.666 -175.12 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -75.4 -17.85 60.09 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.619 0.768 . . . . 0.0 111.128 172.838 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -58.81 135.89 57.62 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 167.44 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.583 ' HG2' ' HB ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -48.68 133.64 16.88 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 124.16 0.912 . . . . 0.0 111.131 174.328 . . . . . . . . 3 3 . 1 . 016 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -157.39 -162.12 1.15 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.297 1.039 . . . . 0.0 109.053 -173.477 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.468 ' HA ' ' O ' ' A' ' 27' ' ' PHE . 25.7 pt20 -75.47 56.89 0.89 Allowed 'General case' 0 CA--C 1.564 1.483 0 C-N-CA 123.094 0.558 . . . . 0.0 111.358 175.243 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.5 t -68.41 160.84 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 124.67 1.188 . . . . 0.0 112.33 -167.844 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 13.2 ptmm? -131.88 136.82 47.72 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.223 171.511 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.3 mp -120.12 144.63 47.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.354 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 19.2 p -111.8 128.86 56.24 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.085 0.554 . . . . 0.0 109.806 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -125.3 156.56 38.45 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 125.05 1.34 . . . . 0.0 108.943 -178.306 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.36 -42.0 97.99 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.246 1.018 . . . . 0.0 111.696 177.108 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.0 p -136.5 168.11 20.1 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 124.013 0.925 . . . . 0.0 110.014 -173.958 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -63.33 -37.38 87.04 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.484 173.701 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -58.55 -41.24 85.15 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 124.148 0.905 . . . . 0.0 111.815 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -70.36 -29.51 66.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.978 0.511 . . . . 0.0 111.817 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.72 -41.22 38.56 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.088 0.555 . . . . 0.0 110.747 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.52 -38.66 65.25 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.648 -177.467 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.78 -36.12 73.91 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 0.0 112.02 172.205 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -64.61 -58.26 6.82 Favored 'General case' 0 C--N 1.349 0.548 0 O-C-N 123.68 0.612 . . . . 0.0 110.011 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.55 -50.06 66.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.607 1.163 . . . . 0.0 112.382 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -60.59 -42.33 96.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.672 0.789 . . . . 0.0 111.163 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -61.93 -30.34 70.84 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.773 1.229 . . . . 0.0 111.152 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.61 -14.29 26.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.291 0.636 . . . . 0.0 111.274 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.39 2.03 83.13 Favored Glycine 0 C--N 1.351 1.374 0 O-C-N 123.15 0.281 . . . . 0.0 113.018 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ILE . . . . . 0.404 HG12 ' HB2' ' A' ' 1' ' ' MET . 61.1 mt -62.23 111.91 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 CA-C-O 121.522 0.677 . . . . 0.0 111.121 178.72 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -61.23 133.31 55.78 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 113.434 -1.712 . . . . 0.0 108.528 169.895 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 53.7 p90 -138.77 143.59 39.03 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.055 0.843 . . . . 0.0 112.652 -171.927 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -110.19 110.57 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.912 1.285 . . . . 0.0 108.567 173.744 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.519 HG12 ' HB ' ' A' ' 5' ' ' ILE . 27.3 m -83.88 128.94 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' A' ' 6' ' ' TYR . 4.2 mp -119.55 126.37 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 172.739 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 80' ' ' ALA . 45.3 mt -76.56 159.91 78.4 Favored Pre-proline 0 CA--C 1.546 0.811 0 CA-C-O 119.298 -0.382 . . . . 0.0 110.247 177.984 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -61.23 166.89 10.19 Favored 'Trans proline' 0 C--N 1.381 2.249 0 C-N-CA 121.939 1.759 . . . . 0.0 111.337 175.075 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.45 11.78 0.16 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 -169.461 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -145.04 13.93 1.47 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.922 0.889 . . . . 0.0 111.418 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.485 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . . . . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -175.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 p -123.72 126.81 47.19 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.354 0.662 . . . . 0.0 110.376 -176.124 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.83 139.24 36.8 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.328 0.651 . . . . 0.0 110.111 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -107.46 127.32 53.5 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.451 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.433 HG21 ' HG3' ' A' ' 58' ' ' GLN . 61.1 mt -107.09 122.94 61.87 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -147.19 176.58 9.86 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.538 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 64.6 ttt180 -141.52 96.02 7.05 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 175.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 74.6 Cg_endo -74.19 -179.3 4.58 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 122.842 2.361 . . . . 0.0 112.754 -170.66 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.01 2.89 56.57 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.318 177.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' A' ' 8' ' ' PRO . 7.5 ptpp? -147.44 157.73 43.69 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.605 0.762 . . . . 0.0 110.582 174.244 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.6 p -142.32 -52.38 0.4 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 172.809 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -162.1 -65.83 0.05 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 170.609 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 99.0 mmm -146.2 164.93 30.71 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 125.629 1.571 . . . . 0.0 107.089 165.735 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -71.61 88.99 0.97 Allowed 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.019 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.2 t -160.73 136.89 8.44 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 123.585 0.754 . . . . 0.0 109.042 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.66 31.39 78.36 Favored Glycine 0 C--N 1.345 1.066 0 O-C-N 123.539 0.525 . . . . 0.0 112.66 -176.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' THR . . . . . 0.565 HG22 HG13 ' A' ' 22' ' ' VAL . 33.9 p -122.4 142.16 50.82 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.006 0.922 . . . . 0.0 110.158 -176.832 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.65 93.29 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.367 0.667 . . . . 0.0 110.993 175.718 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -160.83 128.16 4.26 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.5 p 50.46 -85.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 125.131 1.372 . . . . 0.0 112.731 178.961 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -124.33 154.66 39.98 Favored 'General case' 0 C--N 1.349 0.56 0 C-N-CA 124.28 1.032 . . . . 0.0 108.31 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 22' ' ' VAL . . . . . 0.565 HG13 HG22 ' A' ' 17' ' ' THR . 3.6 m -88.4 170.44 1.25 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.782 0 CA-C-O 121.139 0.495 . . . . 0.0 110.793 176.219 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -84.06 122.21 28.48 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 24' ' ' VAL . . . . . 0.5 HG22 HG22 ' A' ' 54' ' ' THR . 56.0 t -100.93 138.72 24.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.53 -177.088 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -117.43 105.06 11.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -117.11 130.18 56.46 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.3 p90 -143.97 156.94 44.6 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 123.105 0.562 . . . . 0.0 110.224 -177.28 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 28' ' ' ASP . . . . . 0.615 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 34.6 t70 -61.12 105.71 0.52 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 168.709 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.686 ' HB1' HG12 ' A' ' 31' ' ' VAL . . . -55.0 124.8 17.92 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 124.272 0.982 . . . . 0.0 111.669 -170.228 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -86.62 29.08 0.81 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.439 0.695 . . . . 0.0 110.127 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.686 HG12 ' HB1' ' A' ' 29' ' ' ALA . 10.1 p -128.72 123.51 22.13 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 123.41 0.684 . . . . 0.0 110.355 -173.636 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.445 ' HB2' ' HD3' ' A' ' 33' ' ' ARG . 44.5 Cg_endo -87.18 -148.47 0.03 OUTLIER 'Trans proline' 0 C--N 1.371 1.711 0 C-N-CA 123.188 2.592 . . . . 0.0 110.705 166.141 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.445 ' HD3' ' HB2' ' A' ' 32' ' ' PRO . 0.0 OUTLIER -55.42 -30.17 59.95 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.361 0.664 . . . . 0.0 112.301 169.435 . . . . . . . . 3 3 . 1 . 017 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -77.94 90.79 4.15 Favored 'General case' 0 C--N 1.356 0.861 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.682 ' HB ' ' HA2' ' A' ' 40' ' ' GLY . 2.7 pp -99.25 153.36 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 114.91 -1.041 . . . . 0.0 112.175 -169.926 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -76.25 145.55 76.67 Favored Pre-proline 0 N--CA 1.477 0.923 0 C-N-CA 122.693 0.397 . . . . 0.0 110.14 171.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.55 -5.77 16.07 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 122.487 2.124 . . . . 0.0 112.411 173.368 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.2 mm -64.05 -75.15 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.495 0.718 . . . . 0.0 109.668 173.304 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 61.9 mtm -94.5 -71.77 0.65 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.682 ' HA2' ' HB ' ' A' ' 35' ' ' ILE . . . 63.53 24.06 67.42 Favored Glycine 0 C--N 1.348 1.21 0 N-CA-C 115.309 0.884 . . . . 0.0 115.309 171.336 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -95.6 10.81 35.43 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 117.278 0.539 . . . . 0.0 111.394 -177.594 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 17.0 m -82.84 61.7 6.03 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-O 122.218 1.009 . . . . 0.0 109.491 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.5 m -74.64 -12.24 60.39 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.261 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.0 p -55.56 -44.85 77.23 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.878 1.271 . . . . 0.0 111.105 175.318 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.5 t 63.49 12.45 6.4 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.569 1.148 . . . . 0.0 112.029 177.919 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -92.24 77.59 5.21 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.27 0.628 . . . . 0.0 110.187 -170.722 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 63.02 -75.21 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 125.188 1.395 . . . . 0.0 111.172 -178.546 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.38 145.32 6.8 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.683 1.193 . . . . 0.0 109.086 169.781 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 28.6 pt20 -100.43 -153.6 0.45 Allowed 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 174.35 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.615 ' HG2' ' HA ' ' A' ' 28' ' ' ASP . 46.9 mt-30 -123.77 100.49 6.8 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 165.519 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.478 ' H ' ' HB2' ' A' ' 29' ' ' ALA . 31.0 m -82.57 164.02 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 118.17 0.441 . . . . 0.0 111.022 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -146.17 142.84 28.85 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.164 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp -116.77 158.58 23.66 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.819 1.648 . . . . 0.0 108.106 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' THR . . . . . 0.5 HG22 HG22 ' A' ' 24' ' ' VAL . 17.0 p -122.84 133.87 54.42 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.656 0.782 . . . . 0.0 110.973 175.492 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' PHE . . . . . 0.401 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 98.8 m-85 -135.15 153.06 52.11 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.277 1.031 . . . . 0.0 109.897 -178.679 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 6.2 mm-40 -62.85 -32.42 73.64 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.26 0.624 . . . . 0.0 111.356 -179.834 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 34.6 p -135.5 162.11 33.6 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.734 0.814 . . . . 0.0 111.127 -174.984 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' GLN . . . . . 0.433 ' HG3' HG21 ' A' ' 5' ' ' ILE . 41.6 tt0 -58.43 -41.9 86.09 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.705 170.667 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -49.36 -47.7 47.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.137 1.375 . . . . 0.0 112.563 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 51.7 mt-30 -69.32 -30.73 68.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.458 0.703 . . . . 0.0 111.7 -178.133 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.6 -42.51 51.73 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.893 0.477 . . . . 0.0 111.139 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -72.18 -39.27 68.78 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.455 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.37 74.96 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 122.775 0.43 . . . . 0.0 111.956 176.247 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -66.13 -56.58 10.73 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.617 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.26 -48.71 68.03 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.468 1.107 . . . . 0.0 111.903 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -64.66 -40.42 95.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.821 0.848 . . . . 0.0 111.514 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -56.09 -35.51 67.11 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.928 1.291 . . . . 0.0 111.081 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -85.75 -23.11 27.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.789 0.836 . . . . 0.0 110.844 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.56 -0.75 65.7 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-O 120.089 -0.284 . . . . 0.0 112.415 -172.787 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 50.9 mt -65.44 108.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.09 139.75 40.45 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.173 -1.831 . . . . 0.0 108.74 169.001 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -136.58 145.59 45.13 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 118.866 0.757 . . . . 0.0 111.657 -171.963 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -118.21 130.0 55.82 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.703 1.201 . . . . 0.0 108.438 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 48.6 t -102.43 132.52 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 121.81 67.81 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.9 mt -62.18 137.11 95.72 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 122.777 0.431 . . . . 0.0 111.265 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.538 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 84.8 Cg_endo -81.39 179.22 5.99 Favored 'Trans proline' 0 C--N 1.363 1.311 0 C-N-CA 123.356 2.704 . . . . 0.0 114.229 -178.601 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -22.6 66.19 Favored 'General case' 0 CA--C 1.553 1.066 0 CA-C-N 114.169 -1.378 . . . . 0.0 112.669 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -127.15 53.71 1.7 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 122.277 1.037 . . . . 0.0 109.376 173.831 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.863 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.64 177.835 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.411 ' HG3' ' HG2' ' A' ' 30' ' ' GLU . 67.1 mtm . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.9 m -127.21 112.35 15.01 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 175.348 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.85 127.62 44.83 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -169.853 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -109.5 122.1 46.66 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.483 HG13 HD23 ' A' ' 25' ' ' LEU . 3.6 mp -103.6 119.79 52.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 6' ' ' TYR . . . . . 0.427 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 42.8 p90 -143.84 176.45 9.24 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.639 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 78.2 ttt180 -142.68 100.81 5.53 Favored Pre-proline 0 C--N 1.314 -0.954 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -72.77 127.57 12.44 Favored 'Trans proline' 0 C--N 1.368 1.568 0 C-N-CA 122.089 1.859 . . . . 0.0 110.625 -177.193 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.61 -29.65 69.74 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.324 0.583 . . . . 0.0 109.743 171.32 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.1 6.0 38.46 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.469 1.108 . . . . 0.0 112.706 -178.903 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.6 t -68.4 -28.75 67.37 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.552 0.615 . . . . 0.0 111.176 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -161.33 162.29 30.81 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.616 1.166 . . . . 0.0 109.297 179.09 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.5 ptp -63.52 107.56 1.16 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.353 0.661 . . . . 0.0 110.334 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -63.32 102.1 0.37 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.864 0.866 . . . . 0.0 110.835 -179.442 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.7 t -91.14 29.64 1.37 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.914 0.885 . . . . 0.0 111.233 -173.573 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.71 32.18 74.05 Favored Glycine 0 C--N 1.349 1.265 0 CA-C-N 116.383 -0.371 . . . . 0.0 112.604 -176.005 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.1 t -143.8 157.8 44.13 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 123.676 0.79 . . . . 0.0 110.17 -177.382 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' ALA . . . . . 0.463 ' HB1' HH22 ' A' ' 7' ' ' ARG . . . -74.56 -29.38 61.33 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.064 178.276 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -61.33 -36.22 79.54 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.214 0.606 . . . . 0.0 112.14 -175.714 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.3 p -70.54 -5.44 28.98 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -127.55 110.23 12.51 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 171.208 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.7 m -105.77 165.16 3.96 Favored 'Isoleucine or valine' 0 C--O 1.245 0.864 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 23' ' ' TRP . . . . . 0.431 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 66.4 m95 -90.35 131.83 35.92 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.856 0.862 . . . . 0.0 109.039 -176.742 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -100.08 139.3 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.257 177.521 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 53' ' ' LEU . 3.4 tm? -111.34 105.2 13.78 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 175.001 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLU . . . . . 0.654 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 1.8 tm-20 -116.25 124.44 50.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 -174.602 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -140.9 153.27 45.61 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.317 0.962 . . . . 0.0 111.667 -174.835 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -59.6 90.91 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.545 1.138 . . . . 0.0 110.444 170.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.499 ' HB2' HG22 ' A' ' 51' ' ' VAL . . . -76.87 92.35 3.63 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.819 0.848 . . . . 0.0 110.776 -175.122 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.411 ' HG2' ' HG3' ' A' ' 1' ' ' MET . 12.3 pt-20 -79.47 61.82 3.62 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 122.173 0.987 . . . . 0.0 110.213 175.336 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.4 p -66.77 123.95 87.28 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.101 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -76.34 109.34 2.85 Favored 'Trans proline' 0 C--N 1.361 1.215 0 C-N-CA 121.919 1.746 . . . . 0.0 110.838 173.135 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -40.41 8.72 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -177.84 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm 60.87 89.91 0.07 Allowed 'General case' 0 C--N 1.354 0.763 0 O-C-N 125.087 1.492 . . . . 0.0 110.697 176.381 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.639 ' HA ' ' SD ' ' A' ' 39' ' ' MET . 2.8 pp -61.1 133.06 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-O 121.4 0.619 . . . . 0.0 111.179 -173.921 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -119.41 150.74 50.23 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.451 1.1 . . . . 0.0 108.678 -173.293 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -43.24 -37.4 7.0 Favored 'Trans proline' 0 C--N 1.379 2.14 0 C-N-CA 123.818 3.012 . . . . 0.0 114.274 172.01 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.8 mm -73.16 -30.72 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 123.017 0.527 . . . . 0.0 110.899 -178.246 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.639 ' SD ' ' HA ' ' A' ' 35' ' ' ILE . 64.9 mtt -62.22 -49.83 74.2 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.552 0.341 . . . . 0.0 110.097 173.105 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.16 -32.47 2.02 Favored Glycine 0 CA--C 1.537 1.427 0 N-CA-C 115.626 1.01 . . . . 0.0 115.626 170.538 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 2.3 p90 -84.35 47.18 1.31 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.999 0.919 . . . . 0.0 111.757 -169.368 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.6 m -61.4 -26.42 67.84 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.873 0.869 . . . . 0.0 111.921 -174.035 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.6 p -74.32 -43.24 57.5 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.78 0.432 . . . . 0.0 111.174 175.283 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.9 m -93.17 10.32 32.24 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.195 0.598 . . . . 0.0 112.511 -176.47 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.3 p -71.63 92.94 1.2 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.571 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -76.46 172.2 13.34 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.348 -174.461 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.5 ptp -71.66 177.77 3.94 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.217 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -56.54 145.4 28.21 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.926 0.89 . . . . 0.0 111.84 175.735 . . . . . . . . 3 3 . 1 . 018 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -99.39 -165.11 1.19 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.785 176.298 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -137.37 117.57 13.53 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.456 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.499 HG22 ' HB2' ' A' ' 29' ' ' ALA . 32.1 m -106.5 168.54 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.138 0.975 . . . . 0.0 110.825 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.654 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 4.5 ptpp? -133.72 142.7 48.08 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.234 1.016 . . . . 0.0 112.356 -171.946 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 53' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 25' ' ' LEU . 48.9 mt -118.56 154.0 33.31 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.944 1.698 . . . . 0.0 107.213 177.404 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 p -121.36 130.91 53.88 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.06 0.845 . . . . 0.0 110.134 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -129.1 153.49 47.61 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.836 1.655 . . . . 0.0 108.549 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 24.3 mm-40 -67.0 -32.9 74.45 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.789 0.436 . . . . 0.0 111.835 -179.53 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.5 p -134.69 160.61 37.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.415 0.686 . . . . 0.0 111.226 -175.195 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -58.84 -45.53 89.84 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.224 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -50.42 -42.43 53.87 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.635 1.174 . . . . 0.0 112.831 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.0 mt-30 -71.26 -30.89 66.85 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.173 0.589 . . . . 0.0 112.17 -178.059 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.41 -39.79 24.41 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.413 0.685 . . . . 0.0 111.188 -178.239 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -76.37 -39.87 52.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 114.636 -1.165 . . . . 0.0 111.229 -178.04 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.91 -25.88 65.71 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.423 0.689 . . . . 0.0 111.599 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -65.36 -52.44 53.68 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.05 -46.47 75.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.089 0.956 . . . . 0.0 111.415 176.297 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 29.3 mt-30 -58.73 -47.44 84.59 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.424 1.09 . . . . 0.0 111.222 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.0 ttm-85 -59.46 -32.46 70.26 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.136 1.375 . . . . 0.0 111.576 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -94.54 -12.2 28.04 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.422 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.97 -4.97 81.94 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-O 119.921 -0.377 . . . . 0.0 112.732 -178.187 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.44 113.65 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.947 0 C-N-CA 123.656 0.782 . . . . 0.0 110.883 -177.06 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -55.82 134.17 51.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 113.433 -1.712 . . . . 0.0 108.648 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -143.06 149.8 38.69 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 118.237 0.471 . . . . 0.0 110.81 -174.325 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -133.51 141.17 47.63 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 171.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.474 HG12 ' HB ' ' A' ' 5' ' ' ILE . 18.0 m -103.86 139.97 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-O 121.131 0.491 . . . . 0.0 111.18 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' ILE . . . . . 0.427 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.4 mp -109.29 121.94 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 171.786 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 mt -76.17 142.2 71.68 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 122.77 0.428 . . . . 0.0 111.169 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.639 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 72.1 Cg_endo -76.74 -174.02 1.98 Allowed 'Trans proline' 0 C--N 1.373 1.826 0 C-N-CA 123.234 2.623 . . . . 0.0 112.947 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -34.3 78.12 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.677 -176.197 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -82.98 -53.58 5.72 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.729 0.812 . . . . 0.0 109.444 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.506 ' H ' ' HG2' ' A' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 125.357 1.463 . . . . 0.0 113.873 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 t -140.11 166.17 25.39 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.193 -1.039 . . . . 0.0 108.193 -169.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.94 156.15 24.44 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -173.718 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -113.0 126.36 55.42 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.924 1.29 . . . . 0.0 109.099 164.705 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.1 mt -103.21 129.6 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 171.582 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -154.03 -179.14 7.6 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 123.857 0.863 . . . . 0.0 109.552 176.113 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.533 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 37.1 ttt180 -141.39 99.36 6.43 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 106.957 -1.497 . . . . 0.0 106.957 174.254 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 8' ' ' PRO . . . . . 0.525 ' HG2' ' HA ' ' A' ' 11' ' ' THR . 56.1 Cg_endo -66.86 125.95 14.53 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.713 2.275 . . . . 0.0 112.523 -172.021 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.26 83.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.956 0.902 . . . . 0.0 110.263 175.674 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -71.55 -29.08 64.33 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.676 0.791 . . . . 0.0 110.77 174.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 11' ' ' THR . . . . . 0.525 ' HA ' ' HG2' ' A' ' 8' ' ' PRO . 18.8 m 66.69 -74.5 0.06 Allowed 'General case' 0 C--N 1.355 0.837 0 C-N-CA 125.441 1.496 . . . . 0.0 111.727 -178.186 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.81 125.06 22.69 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.745 0.818 . . . . 0.0 110.974 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' MET . . . . . 0.553 ' SD ' ' HE3' ' A' ' 52' ' ' LYS . 52.8 mtt -106.68 -40.32 5.57 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.78 0.832 . . . . 0.0 108.808 177.06 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -160.67 87.49 0.75 Allowed 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 114.952 -1.022 . . . . 0.0 108.594 170.331 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -167.54 -34.35 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.824 0.85 . . . . 0.0 110.525 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.93 47.45 9.46 Favored Glycine 0 C--N 1.35 1.332 0 O-C-N 123.323 0.389 . . . . 0.0 112.489 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.1 p -103.95 166.58 10.32 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.109 0.964 . . . . 0.0 110.425 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.28 160.46 32.35 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.276 175.864 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.8 mppt? -77.56 78.29 4.07 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.078 0.551 . . . . 0.0 109.954 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' THR . . . . . 0.478 HG22 HG21 ' A' ' 11' ' ' THR . 8.9 t -84.84 -27.52 26.69 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.51 0.724 . . . . 0.0 110.335 178.541 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 62.89 94.48 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.178 1.391 . . . . 0.0 111.382 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.1 p -115.07 146.51 19.41 Favored 'Isoleucine or valine' 0 C--O 1.245 0.844 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 172.721 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -75.93 125.8 29.8 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -173.105 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 90.9 t -102.07 139.22 23.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.11 105.97 13.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 169.071 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -104.32 133.35 49.36 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.484 ' O ' ' HA ' ' A' ' 50' ' ' GLN . 27.9 p90 -144.98 149.52 35.32 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.019 -175.278 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.6 91.28 0.02 OUTLIER 'General case' 0 C--O 1.242 0.687 0 O-C-N 124.411 1.07 . . . . 0.0 109.093 165.833 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' ALA . . . . . 0.528 ' HB2' HG22 ' A' ' 51' ' ' VAL . . . -73.53 136.77 44.11 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.646 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -11.93 61.24 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.35 1.06 . . . . 0.0 111.734 176.55 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 31' ' ' VAL . . . . . 0.631 HG13 ' HA ' ' A' ' 48' ' ' LYS . 3.0 p -23.53 96.77 0.06 OUTLIER Pre-proline 0 N--CA 1.493 1.723 0 C-N-CA 126.647 1.979 . . . . 0.0 114.288 -173.664 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -87.16 -161.67 0.13 Allowed 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 123.581 2.854 . . . . 0.0 111.843 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -32.03 73.42 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.296 171.024 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -74.8 87.92 2.26 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 123.781 0.833 . . . . 0.0 110.711 -179.468 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 35' ' ' ILE . . . . . 0.592 HD11 ' HA3' ' A' ' 40' ' ' GLY . 19.7 pt -137.17 -163.83 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 124.595 1.158 . . . . 0.0 108.458 175.784 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' ASP . . . . . 0.652 ' HB2' ' HG2' ' A' ' 39' ' ' MET . 7.8 m-20 -51.69 124.92 27.72 Favored Pre-proline 0 N--CA 1.476 0.86 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.23 175.371 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.4 -16.45 29.11 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 123.256 2.638 . . . . 0.0 112.983 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 42.8 mm -71.05 -49.57 48.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 124.807 1.243 . . . . 0.0 111.275 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' MET . . . . . 0.652 ' HG2' ' HB2' ' A' ' 36' ' ' ASP . 27.3 ptm -110.37 153.28 25.17 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -169.166 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 40' ' ' GLY . . . . . 0.592 ' HA3' HD11 ' A' ' 35' ' ' ILE . . . 84.71 -11.18 60.09 Favored Glycine 0 C--N 1.351 1.404 0 N-CA-C 115.068 0.787 . . . . 0.0 115.068 169.791 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -91.47 6.1 46.85 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 117.336 0.568 . . . . 0.0 111.538 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.2 p -66.75 159.92 26.89 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.483 0.713 . . . . 0.0 110.907 170.738 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.5 t -58.33 -40.08 81.18 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.716 0.806 . . . . 0.0 110.972 -179.337 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 60.3 p -93.78 86.91 5.25 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 172.415 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.9 p -101.18 130.18 47.23 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 123.74 0.816 . . . . 0.0 109.823 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -86.62 135.73 33.31 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.264 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -71.61 -175.37 1.32 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.479 0.712 . . . . 0.0 111.568 -176.756 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.631 ' HA ' HG13 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -61.04 143.72 54.83 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.267 178.741 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -155.14 177.56 11.2 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.651 0.78 . . . . 0.0 110.255 -169.433 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLN . . . . . 0.484 ' HA ' ' O ' ' A' ' 27' ' ' PHE . 25.3 mp0 -85.41 103.06 13.96 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 122.874 0.47 . . . . 0.0 110.291 -179.281 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 51' ' ' VAL . . . . . 0.528 HG22 ' HB2' ' A' ' 29' ' ' ALA . 16.6 m -100.21 168.79 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 172.188 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.553 ' HE3' ' SD ' ' A' ' 13' ' ' MET . 23.5 pttm -144.14 148.33 34.91 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.93 0.871 . . . . 0.0 113.263 -167.569 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.7 mp -120.99 155.65 33.83 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.85 -1.523 . . . . 0.0 107.855 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -118.15 130.66 56.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.348 0.659 . . . . 0.0 110.252 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.75 153.05 48.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.358 1.463 . . . . 0.0 109.206 -175.334 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 56' ' ' GLU . . . . . 0.432 ' HB2' HE22 ' A' ' 60' ' ' GLN . 14.7 mm-40 -72.01 -29.86 64.63 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.187 0.595 . . . . 0.0 111.745 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.9 p -136.44 163.42 30.52 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.431 0.692 . . . . 0.0 110.758 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -57.5 -44.58 85.12 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.796 0.838 . . . . 0.0 110.615 172.162 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 59' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 41.8 mt-10 -56.61 -39.09 72.99 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 124.677 1.235 . . . . 0.0 111.969 -174.919 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 60' ' ' GLN . . . . . 0.432 HE22 ' HB2' ' A' ' 56' ' ' GLU . 78.6 mt-30 -64.04 -39.66 94.57 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.484 0.714 . . . . 0.0 111.541 175.096 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.4 -40.05 62.27 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.302 0.641 . . . . 0.0 111.768 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 62' ' ' GLU . . . . . 0.514 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.7 pt-20 -76.82 -43.01 38.18 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.135 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.99 -27.21 65.49 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 123.168 0.587 . . . . 0.0 111.431 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -64.21 -54.31 35.48 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 172.694 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.33 -48.41 74.22 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.586 1.154 . . . . 0.0 111.833 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.5 mt-30 -60.7 -43.9 97.21 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.421 1.088 . . . . 0.0 111.432 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -64.0 -28.1 69.58 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.587 1.155 . . . . 0.0 111.552 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.87 -13.53 27.1 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.264 0.626 . . . . 0.0 111.116 177.622 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.02 -1.12 82.8 Favored Glycine 0 C--N 1.354 1.529 0 O-C-N 123.332 0.395 . . . . 0.0 113.252 -176.349 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.8 mt -63.17 110.67 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.294 0 CA-C-O 121.836 0.827 . . . . 0.0 110.807 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -65.68 137.28 57.21 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.352 -1.749 . . . . 0.0 109.137 171.595 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -140.44 149.76 42.98 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.669 0.668 . . . . 0.0 112.486 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -108.52 111.59 23.53 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.164 0.986 . . . . 0.0 109.5 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 76.7 t -79.64 118.22 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.477 0.711 . . . . 0.0 109.819 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 27.6 mt -122.86 97.48 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.438 1.495 . . . . 0.0 107.495 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 76' ' ' LEU . . . . . 0.4 ' HB3' ' HB3' ' A' ' 80' ' ' ALA . 62.8 mt -68.38 146.39 97.84 Favored Pre-proline 0 CA--C 1.554 1.109 0 C-N-CA 123.264 0.626 . . . . 0.0 112.386 -173.831 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.533 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 72.9 Cg_endo -73.28 177.92 7.27 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.312 2.675 . . . . 0.0 113.487 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -65.27 -23.44 67.04 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -169.823 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -99.6 -12.11 20.37 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 122.568 0.347 . . . . 0.0 111.731 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' ALA . . . . . 0.4 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . . . . . . . . 0 N--CA 1.484 1.26 0 C-N-CA 122.844 0.457 . . . . 0.0 111.708 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m -121.06 121.34 37.7 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.827 0.851 . . . . 0.0 109.078 -177.151 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' ALA . . . . . 0.487 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.28 128.84 47.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.234 0.614 . . . . 0.0 109.998 -174.806 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -109.04 123.79 49.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 176.698 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' ILE . . . . . 0.544 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.7 mp -109.17 121.14 61.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -148.42 170.87 17.05 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -172.911 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' ARG . . . . . 0.749 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 58.0 ttt180 -139.36 96.3 8.86 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.32 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -73.72 167.0 28.34 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.488 2.125 . . . . 0.0 112.023 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.66 -39.3 73.69 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.752 0.421 . . . . 0.0 109.986 175.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -86.8 146.56 26.19 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.289 173.792 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 p -160.17 -172.76 3.73 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 125.003 1.321 . . . . 0.0 108.741 179.32 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.31 -179.83 6.5 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 122.705 0.402 . . . . 0.0 110.113 169.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 66.3 mtm -89.73 -177.61 5.31 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.598 0.759 . . . . 0.0 111.599 -175.869 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -67.5 110.99 3.87 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.428 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.6 p -160.48 176.5 11.56 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 122.814 0.446 . . . . 0.0 110.953 -171.305 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.79 -23.0 76.11 Favored Glycine 0 C--N 1.345 1.063 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.13 172.761 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.9 t -84.99 -25.3 27.82 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.454 0.702 . . . . 0.0 111.648 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -142.78 128.9 19.73 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.907 0.483 . . . . 0.0 111.656 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -83.71 57.39 4.07 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.257 1.023 . . . . 0.0 109.812 176.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.3 m 67.76 -69.85 0.13 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.301 1.441 . . . . 0.0 112.173 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -142.79 115.74 8.8 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.377 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.3 m -132.68 -177.25 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.005 0.922 . . . . 0.0 110.614 -177.235 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -88.79 129.1 35.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.414 1.085 . . . . 0.0 108.86 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -101.35 137.28 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.429 HD21 ' HB1' ' A' ' 3' ' ' ALA . 5.6 tt -112.45 108.56 17.74 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 175.017 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -114.14 132.7 55.98 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' PHE . . . . . 0.487 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 3.3 p90 -144.79 157.77 44.04 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.555 0.693 . . . . 0.0 112.615 -178.318 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -59.54 110.43 1.12 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 106.166 -1.79 . . . . 0.0 106.166 160.535 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.49 143.13 36.32 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -168.31 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.26 11.82 2.19 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.557 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.4 p -153.1 140.14 12.94 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 124.49 1.116 . . . . 0.0 108.41 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' PRO . . . . . 0.472 ' HA ' ' HA ' ' A' ' 48' ' ' LYS . 74.4 Cg_endo -72.25 -174.46 1.41 Allowed 'Trans proline' 0 C--N 1.375 1.959 0 C-N-CA 122.223 1.948 . . . . 0.0 111.589 169.297 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 33' ' ' ARG . . . . . 0.539 ' HG3' ' HA ' ' A' ' 42' ' ' THR . 0.0 OUTLIER -62.14 -28.6 69.76 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.482 0.658 . . . . 0.0 109.985 167.618 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -81.89 95.22 7.28 Favored 'General case' 0 C--N 1.35 0.618 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.801 -170.613 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 12.7 pt -98.92 -100.86 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 161.12 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -75.6 158.24 83.35 Favored Pre-proline 0 CA--C 1.55 0.953 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 154.752 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -64.11 -4.64 8.0 Favored 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 122.557 2.171 . . . . 0.0 113.81 176.775 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.5 mm -54.34 -36.52 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 125.107 1.363 . . . . 0.0 112.194 177.046 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 80.8 mtp -82.37 63.38 6.52 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-O 121.565 0.697 . . . . 0.0 111.703 178.532 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.62 10.37 43.56 Favored Glycine 0 C--N 1.352 1.42 0 CA-C-N 114.722 -1.126 . . . . 0.0 115.595 171.371 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 61.64 -73.65 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.888 1.275 . . . . 0.0 110.143 -171.224 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 42' ' ' THR . . . . . 0.539 ' HA ' ' HG3' ' A' ' 33' ' ' ARG . 8.1 t -152.01 117.5 5.34 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.391 1.077 . . . . 0.0 109.539 170.046 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.2 m -73.89 -49.11 26.41 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.541 0.736 . . . . 0.0 111.454 -176.432 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.6 t -151.77 50.19 0.8 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.264 0.625 . . . . 0.0 110.512 -176.381 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.5 m 56.32 53.43 8.8 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.074 0.949 . . . . 0.0 110.413 178.331 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ASP . . . . . 0.41 ' HB2' ' HD2' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -86.96 83.76 7.45 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 114.671 -1.15 . . . . 0.0 109.503 -167.916 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 55.6 tpp -58.61 -31.57 68.21 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-O 121.429 0.633 . . . . 0.0 109.953 175.263 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HA ' ' HA ' ' A' ' 32' ' ' PRO . 0.0 OUTLIER -145.19 157.48 44.07 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.132 166.515 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -100.75 -161.01 0.83 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 170.832 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -119.85 144.92 47.1 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 168.238 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.2 t -134.72 146.53 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 52' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 6.5 ptpp? -138.8 134.48 33.46 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.331 172.917 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.24 159.88 18.87 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.952 1.301 . . . . 0.0 107.749 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -125.82 129.82 50.16 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.17 0.509 . . . . 0.0 110.118 170.417 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -127.04 150.36 49.48 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.547 1.539 . . . . 0.0 108.734 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 43.8 mt-10 -72.43 -26.15 61.74 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.412 0.685 . . . . 0.0 111.763 -176.647 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.1 p -130.34 159.78 35.93 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.453 0.701 . . . . 0.0 109.619 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -62.71 -39.26 93.47 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.495 171.423 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -55.33 -41.12 72.02 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.367 1.042 . . . . 0.0 111.874 -176.077 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 54.5 mt-30 -68.21 -32.78 73.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.099 0.56 . . . . 0.0 111.395 179.349 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.45 -41.44 21.82 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.506 0.723 . . . . 0.0 111.326 -175.934 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.39 -38.91 74.76 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.843 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.36 71.09 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.159 0.584 . . . . 0.0 112.078 175.058 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -63.33 -59.15 5.09 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.73 73.7 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.12 0.968 . . . . 0.0 111.662 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 51.0 mt-30 -65.86 -42.65 90.16 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.178 0.991 . . . . 0.0 111.799 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -55.66 -38.34 69.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.566 1.146 . . . . 0.0 110.684 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -80.77 -26.41 37.27 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.823 0.849 . . . . 0.0 110.754 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.86 -5.26 69.07 Favored Glycine 0 C--N 1.349 1.301 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.541 -169.741 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.68 112.13 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-O 121.437 0.637 . . . . 0.0 110.644 -178.09 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.95 135.34 36.82 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 113.149 -1.841 . . . . 0.0 108.821 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -143.04 145.93 33.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.428 0.558 . . . . 0.0 111.207 -170.627 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -125.64 114.01 18.14 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' VAL . . . . . 0.544 HG12 ' HB ' ' A' ' 5' ' ' ILE . 24.5 m -84.53 139.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.92 0.488 . . . . 0.0 111.077 177.522 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.83 126.29 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.469 1.508 . . . . 0.0 107.412 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.8 mt -69.14 144.01 94.76 Favored Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 122.927 0.491 . . . . 0.0 110.535 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' PRO . . . . . 0.749 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 81.7 Cg_endo -79.08 177.05 9.11 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 122.84 2.36 . . . . 0.0 112.901 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -16.66 64.32 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.537 172.355 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -112.34 41.35 2.02 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.292 1.437 . . . . 0.0 109.316 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 O-C-N 121.534 -0.729 . . . . 0.0 112.759 -176.674 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.6 p . . . . . 0 N--CA 1.48 1.049 0 CA-C-O 120.396 0.141 . . . . 0.0 110.776 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -102.6 127.53 49.65 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.844 0.858 . . . . 0.0 109.172 175.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB2' HD13 ' A' ' 75' ' ' ILE . 17.2 ptpt -108.72 124.23 50.23 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -177.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.462 HG13 HD13 ' A' ' 25' ' ' LEU . 4.0 mp -107.87 121.24 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.483 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.9 p90 -150.59 160.05 44.08 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.429 0.633 . . . . 0.0 112.132 -173.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 11.9 mtp180 -122.16 96.61 46.3 Favored Pre-proline 0 N--CA 1.478 0.97 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 168.256 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 73.1 Cg_endo . . . . . 0 CA--C 1.552 1.424 0 C-N-CA 122.623 2.215 . . . . 0.0 111.676 178.297 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.7 p . . . . . 0 C--O 1.249 1.076 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 75.7 m95 -82.51 125.43 31.11 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 177.284 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.9 t -100.07 135.97 33.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.53 HD11 ' HB1' ' A' ' 3' ' ' ALA . 51.2 tp -116.37 104.0 11.03 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 36.6 tt0 -104.97 135.92 45.41 Favored 'General case' 0 C--O 1.214 -0.772 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 176.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.6 p90 . . . . . 0 C--O 1.239 0.537 0 CA-C-N 118.559 0.618 . . . . 0.0 111.876 -178.642 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.6 m . . . . . 0 N--CA 1.474 0.734 0 N-CA-C 109.614 -0.513 . . . . 0.0 109.614 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -142.9 149.28 38.26 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-O 122.025 0.917 . . . . 0.0 113.437 -173.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.42 HD12 HD23 ' A' ' 25' ' ' LEU . 50.5 mt -119.2 158.9 25.06 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.522 1.929 . . . . 0.0 107.588 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.1 p -122.31 129.05 51.78 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 118.43 0.559 . . . . 0.0 110.622 175.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -130.63 148.53 52.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.258 1.423 . . . . 0.0 108.936 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.09 -22.36 62.11 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.771 0.428 . . . . 0.0 111.579 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.3 p -132.47 157.21 45.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.217 0.607 . . . . 0.0 111.169 178.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -58.82 -43.85 90.71 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.276 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -59.05 -35.54 73.52 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.687 1.242 . . . . 0.0 111.494 -175.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -74.03 -30.02 62.21 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.076 0.551 . . . . 0.0 112.04 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.33 -37.83 31.79 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.366 0.603 . . . . 0.0 110.903 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -71.92 -37.71 70.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.368 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.39 70.61 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.645 0.778 . . . . 0.0 112.171 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -61.3 -60.3 3.94 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB1' ' O ' ' A' ' 70' ' ' ILE . . . -51.99 -47.69 64.76 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.973 1.309 . . . . 0.0 112.046 -177.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -60.81 -46.47 90.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.369 1.068 . . . . 0.0 111.341 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.7 ttt85 -63.36 -31.81 73.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.588 1.155 . . . . 0.0 111.396 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.21 -14.81 35.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.177 0.591 . . . . 0.0 111.462 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.04 -3.4 76.93 Favored Glycine 0 C--N 1.35 1.348 0 C-N-CA 122.823 0.249 . . . . 0.0 112.789 -176.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.407 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 59.3 mt -69.29 106.46 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -55.1 143.88 25.65 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.397 170.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -135.8 146.84 47.97 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.61 0.641 . . . . 0.0 112.116 -170.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -114.36 125.36 53.78 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 171.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 90.9 t -90.45 126.73 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 110.16 175.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.483 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 mp -105.93 112.39 39.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 170.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 72.0 mt . . . . . 0 CA--C 1.547 0.863 0 C-N-CA 123.633 0.773 . . . . 0.0 111.665 179.756 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.8 p . . . . . 0 N--CA 1.474 0.76 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.49 134.59 44.35 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.87 0.468 . . . . 0.0 110.908 -167.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.56 122.82 48.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 176.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.513 ' HB ' HG12 ' A' ' 74' ' ' VAL . 5.1 mp -107.21 122.57 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -147.78 172.99 13.24 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -175.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 27.5 ttp180 -116.48 119.99 35.31 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 170.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.503 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 29.6 Cg_endo . . . . . 0 CA--C 1.55 1.319 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 177.807 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.503 ' O ' ' HD2' ' A' ' 8' ' ' PRO . 28.8 m . . . . . 0 N--CA 1.47 0.544 0 N-CA-C 109.172 -0.677 . . . . 0.0 109.172 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.7 m95 -93.11 132.75 36.96 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.39 0.676 . . . . 0.0 109.319 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.487 HG22 HG22 ' A' ' 54' ' ' THR . 70.3 t -102.54 138.66 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 tt -112.99 108.26 17.1 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -119.94 131.15 55.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.433 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 35.0 p90 . . . . . 0 N--CA 1.472 0.64 0 C-N-CA 123.522 0.729 . . . . 0.0 111.058 -178.628 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.8 m . . . . . 0 N--CA 1.477 0.877 0 N-CA-C 109.435 -0.58 . . . . 0.0 109.435 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.5 136.03 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.676 0.75 . . . . 0.0 111.363 -175.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.5 mp -123.81 153.91 40.33 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.591 1.556 . . . . 0.0 107.448 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.487 HG22 HG22 ' A' ' 24' ' ' VAL . 17.1 p -120.54 125.18 47.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.381 0.991 . . . . 0.0 111.154 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -124.44 145.49 49.47 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.905 1.682 . . . . 0.0 107.448 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.463 ' HB2' HE22 ' A' ' 60' ' ' GLN . 45.8 mt-10 -69.99 -22.63 63.12 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -172.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 45.1 p -135.72 162.38 32.93 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 110.146 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -61.64 -40.93 96.66 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.57 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -59.49 -39.54 84.09 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.713 0.805 . . . . 0.0 111.585 -175.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.463 HE22 ' HB2' ' A' ' 56' ' ' GLU . 49.1 mt-30 -67.7 -33.21 74.45 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.936 0.495 . . . . 0.0 111.337 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.03 -39.68 25.43 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.148 0.499 . . . . 0.0 111.046 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.38 -39.0 63.0 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.305 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.29 -32.34 73.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.485 0.714 . . . . 0.0 111.76 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -66.69 -49.25 66.7 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.16 84.07 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.094 0.958 . . . . 0.0 111.187 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -62.64 -42.96 99.89 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.957 0.903 . . . . 0.0 111.324 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -55.48 -36.74 66.94 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.965 1.306 . . . . 0.0 110.825 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -87.09 -21.0 26.3 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.041 -0.982 . . . . 0.0 110.882 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.62 -10.68 66.74 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.265 -0.742 . . . . 0.0 112.536 -174.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 52.7 mt -52.63 114.3 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.818 0.847 . . . . 0.0 111.512 -173.224 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -58.14 130.4 46.44 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 113.861 -1.518 . . . . 0.0 108.739 170.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -142.16 146.64 35.53 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.045 0.45 . . . . 0.0 111.509 -169.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -114.86 133.81 55.66 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.683 1.193 . . . . 0.0 107.797 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.513 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.7 m -103.32 127.48 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-O 121.389 0.614 . . . . 0.0 109.426 174.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.26 132.25 68.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 C-N-CA 125.432 1.493 . . . . 0.0 107.282 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 34.4 mt . . . . . 0 C--O 1.24 0.564 0 O-C-N 122.997 0.186 . . . . 0.0 110.573 173.84 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 50.4 m . . . . . 0 N--CA 1.473 0.68 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.11 136.41 41.0 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.965 0.506 . . . . 0.0 109.716 -173.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -108.24 123.55 48.95 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.481 HG12 HD13 ' A' ' 25' ' ' LEU . 59.3 mt -104.29 121.04 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -146.59 176.63 9.68 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.3 ttt180 -136.41 94.62 13.55 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.075 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo . . . . . 0 C--N 1.368 1.587 0 C-N-CA 123.483 2.789 . . . . 0.0 111.559 -172.981 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.8 m . . . . . 0 N--CA 1.477 0.901 0 N-CA-C 111.547 0.203 . . . . 0.0 111.547 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -84.88 129.54 34.79 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.9 t -102.74 138.49 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.396 0.617 . . . . 0.0 109.739 175.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.481 HD13 HG12 ' A' ' 5' ' ' ILE . 60.4 tp -116.06 105.49 12.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -114.41 131.11 56.7 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.4 p90 . . . . . 0 C--O 1.235 0.317 0 C-N-CA 124.236 1.014 . . . . 0.0 110.713 178.21 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.472 0.638 0 N-CA-C 109.087 -0.708 . . . . 0.0 109.087 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -142.62 136.25 28.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.631 0.729 . . . . 0.0 111.377 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.4 mp -121.64 147.59 45.66 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 113.866 -1.516 . . . . 0.0 107.2 -178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.4 p -113.16 132.55 55.43 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.261 0.624 . . . . 0.0 110.186 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.7 m-85 -132.85 148.24 52.3 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.298 1.439 . . . . 0.0 108.509 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.411 ' HB2' HE22 ' A' ' 60' ' ' GLN . 44.0 mt-10 -70.15 -26.75 64.08 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 123.283 0.364 . . . . 0.0 111.915 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 58.6 p -133.17 163.27 29.66 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.05 0.54 . . . . 0.0 110.096 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -62.13 -39.1 91.42 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 114.959 -1.018 . . . . 0.0 110.828 171.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -53.06 -43.16 66.47 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.473 1.109 . . . . 0.0 111.469 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.489 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 64.3 mt-30 -67.74 -36.25 80.21 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.064 0.945 . . . . 0.0 111.395 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.03 -39.7 55.1 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.973 0.509 . . . . 0.0 111.127 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -70.85 -37.48 73.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.562 177.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.37 -38.72 69.21 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.523 0.729 . . . . 0.0 111.925 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -63.39 -60.62 3.14 Favored 'General case' 0 C--N 1.351 0.64 0 C-N-CA 123.325 0.65 . . . . 0.0 110.005 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.41 -47.41 66.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.489 1.115 . . . . 0.0 112.293 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -61.9 -45.8 92.17 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.006 0.922 . . . . 0.0 111.452 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -59.72 -34.37 72.84 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.081 0.952 . . . . 0.0 110.936 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -86.87 -20.56 27.26 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.333 0.653 . . . . 0.0 111.407 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.18 2.05 74.73 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 116.643 -0.253 . . . . 0.0 112.786 -173.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.97 110.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 122.568 0.347 . . . . 0.0 110.179 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.6 pt-20 -58.58 136.93 57.71 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 124.95 1.407 . . . . 0.0 108.407 170.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -144.42 151.52 39.36 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.357 0.526 . . . . 0.0 110.997 -171.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.459 ' NH1' HG13 ' A' ' 75' ' ' ILE . 3.5 tmt_? -125.44 140.34 52.86 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.516 1.127 . . . . 0.0 108.26 171.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -105.57 136.84 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.352 0.661 . . . . 0.0 111.032 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.459 HG13 ' NH1' ' A' ' 73' ' ' ARG . 2.3 mp -111.26 150.47 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.4 mt . . . . . 0 CA--C 1.556 1.205 0 C-N-CA 122.841 0.457 . . . . 0.0 110.987 173.959 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.9 m . . . . . 0 N--CA 1.478 0.961 0 CA-C-O 120.684 0.278 . . . . 0.0 111.197 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -102.31 144.39 30.86 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -107.71 124.92 50.73 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.62 HG21 ' HG2' ' A' ' 58' ' ' GLN . 70.3 mt -103.28 123.71 56.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.315 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 172.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -148.46 176.22 10.49 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 60.2 ttt180 -141.68 97.52 6.59 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 174.099 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo . . . . . 0 C--N 1.36 1.136 0 C-N-CA 121.715 1.61 . . . . 0.0 111.714 -176.108 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.7 m . . . . . 0 N--CA 1.474 0.768 0 N-CA-C 109.8 -0.444 . . . . 0.0 109.8 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -85.17 132.17 34.33 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.6 t -101.06 139.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.13 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.516 HD23 HG12 ' A' ' 5' ' ' ILE . 3.4 tm? -116.84 104.6 11.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -107.81 137.48 45.75 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.4 p90 . . . . . 0 N--CA 1.476 0.86 0 C-N-CA 123.174 0.59 . . . . 0.0 109.9 -178.887 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.4 t . . . . . 0 C--O 1.24 0.568 0 N-CA-C 108.498 -0.927 . . . . 0.0 108.498 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -137.44 146.54 44.47 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.772 0.796 . . . . 0.0 111.628 -173.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp -119.61 157.27 28.77 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.978 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 48.5 p -121.73 131.6 54.17 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 110.193 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -128.17 147.49 50.56 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.503 1.521 . . . . 0.0 107.982 178.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.05 -24.21 64.15 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.656 0.382 . . . . 0.0 111.84 -176.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 79.8 p -132.99 160.5 36.96 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 123.927 0.891 . . . . 0.0 110.193 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.62 ' HG2' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -60.88 -40.41 92.91 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.078 0.951 . . . . 0.0 110.317 170.803 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -57.3 -39.7 76.32 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.75 1.22 . . . . 0.0 111.754 -174.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -70.93 -30.78 67.19 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 122.963 0.505 . . . . 0.0 112.013 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.2 -40.08 53.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.202 0.601 . . . . 0.0 111.14 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -37.59 67.2 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.951 177.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.78 77.24 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.244 0.618 . . . . 0.0 111.98 173.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -65.61 -59.33 4.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.532 0.733 . . . . 0.0 110.384 176.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.28 -49.52 69.42 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.544 1.138 . . . . 0.0 112.583 -177.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -64.18 -37.84 88.9 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.402 0.681 . . . . 0.0 111.73 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -62.17 -30.96 71.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.929 0.892 . . . . 0.0 110.692 175.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -85.92 -21.93 27.7 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.496 0.718 . . . . 0.0 110.629 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.6 -1.75 62.08 Favored Glycine 0 C--N 1.35 1.354 0 O-C-N 123.321 0.388 . . . . 0.0 112.722 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 26.8 mt -68.11 109.34 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-O 121.601 0.715 . . . . 0.0 110.144 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -58.08 141.34 50.38 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.772 169.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -141.12 149.86 42.11 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.146 0.43 . . . . 0.0 111.391 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -120.97 127.65 52.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.747 0.819 . . . . 0.0 109.494 172.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.402 HG22 HD12 ' A' ' 5' ' ' ILE . 35.1 t -102.51 134.83 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 123.761 0.825 . . . . 0.0 108.872 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.9 mt -130.71 121.04 49.42 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -178.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 75.1 mt . . . . . 0 CA--C 1.544 0.713 0 C-N-CA 123.744 0.817 . . . . 0.0 112.032 -175.217 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m . . . . . 0 N--CA 1.481 1.088 0 CA-C-O 120.651 0.263 . . . . 0.0 110.96 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.42 137.46 37.89 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.479 0.711 . . . . 0.0 109.224 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -112.81 123.69 50.89 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 mp -105.93 123.31 60.41 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 N-CA-C 106.779 -1.564 . . . . 0.0 106.779 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -150.88 174.53 12.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.224 1.01 . . . . 0.0 108.354 -177.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.2 ttt180 -139.73 98.08 7.98 Favored Pre-proline 0 C--O 1.242 0.688 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.497 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo . . . . . 0 C--N 1.366 1.498 0 C-N-CA 122.707 2.271 . . . . 0.0 112.186 -175.823 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m . . . . . 0 N--CA 1.474 0.756 0 N-CA-C 109.824 -0.435 . . . . 0.0 109.824 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -85.96 132.57 34.05 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -176.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.1 t -102.12 138.44 26.36 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.489 HD22 HD23 ' A' ' 53' ' ' LEU . 9.1 tt -114.82 107.81 15.92 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 172.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -108.7 134.84 50.88 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 174.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 2.1 p90 . . . . . 0 N--CA 1.474 0.756 0 CA-C-N 118.546 0.612 . . . . 0.0 112.053 -176.439 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 58.6 t . . . . . 0 N--CA 1.479 0.977 0 CA-C-O 120.687 0.28 . . . . 0.0 111.546 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.5 ptpt -133.69 132.43 40.65 Favored 'General case' 0 C--N 1.352 0.681 0 CA-C-O 121.771 0.796 . . . . 0.0 110.826 174.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.489 HD23 HD22 ' A' ' 25' ' ' LEU . 2.0 mm? -115.83 148.41 39.95 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.8 p -114.86 130.93 56.98 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.67 -0.644 . . . . 0.0 109.677 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -130.84 146.48 52.29 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.469 1.507 . . . . 0.0 108.32 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -68.63 -27.16 65.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.797 0.439 . . . . 0.0 112.169 -175.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.4 p -134.3 159.28 41.48 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.629 0.771 . . . . 0.0 110.352 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -56.33 -46.29 79.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.65 1.18 . . . . 0.0 111.4 172.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -51.19 -45.42 61.81 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 124.909 1.381 . . . . 0.0 111.992 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -70.85 -29.14 65.18 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.609 0.764 . . . . 0.0 111.774 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.66 -44.42 28.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.033 0.533 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.49 -37.75 74.27 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.649 -177.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.35 -36.35 75.55 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.403 0.681 . . . . 0.0 112.302 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -62.66 -57.13 12.11 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.254 0.621 . . . . 0.0 109.905 177.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.58 -47.74 66.66 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.494 1.117 . . . . 0.0 111.777 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -60.06 -45.92 91.26 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.248 1.019 . . . . 0.0 112.004 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -60.54 -31.0 70.12 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.147 . . . . 0.0 111.172 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -87.84 -21.03 25.27 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.621 0.769 . . . . 0.0 111.059 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.52 -3.8 63.67 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-O 119.984 -0.342 . . . . 0.0 112.628 -174.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 48.1 mt -63.14 108.89 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 CA-C-O 121.048 0.452 . . . . 0.0 109.873 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -57.73 139.99 52.55 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.489 172.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.0 p90 -142.18 147.8 37.19 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.851 0.751 . . . . 0.0 112.102 -168.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -121.04 110.4 16.2 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 175.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.4 t -83.73 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.6 mt -121.65 129.17 75.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 125.931 1.692 . . . . 0.0 108.04 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.6 mt . . . . . 0 CA--C 1.541 0.633 0 O-C-N 123.321 0.388 . . . . 0.0 110.863 175.724 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 20.1 t . . . . . 0 N--CA 1.471 0.585 0 N-CA-C 109.884 -0.413 . . . . 0.0 109.884 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.66 136.55 40.35 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.608 0.763 . . . . 0.0 109.712 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -108.84 120.1 41.49 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 107.197 -1.409 . . . . 0.0 107.197 175.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.447 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.2 mp -104.54 123.15 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 177.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -151.48 173.04 15.06 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -176.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 68.0 ttt180 -138.84 97.16 9.05 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.082 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo . . . . . 0 C--N 1.365 1.421 0 C-N-CA 122.285 1.99 . . . . 0.0 111.502 -175.119 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.451 HG23 HG22 ' A' ' 54' ' ' THR . 9.6 m . . . . . 0 N--CA 1.48 1.031 0 CA-C-O 120.626 0.25 . . . . 0.0 110.938 . . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.6 m95 -88.88 132.75 34.54 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.068 0.947 . . . . 0.0 109.338 -172.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.7 t -101.44 138.84 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.511 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 53.8 tp -114.42 106.69 14.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 125.369 1.468 . . . . 0.0 107.17 176.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -115.46 132.38 56.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.5 p90 . . . . . 0 C--O 1.243 0.746 0 C-N-CA 123.357 0.663 . . . . 0.0 110.592 177.163 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 p . . . . . 0 N--CA 1.472 0.63 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -138.79 138.69 37.82 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.515 176.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp -119.18 151.71 37.86 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.451 HG22 HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -122.88 128.45 50.36 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.644 0.657 . . . . 0.0 110.539 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -129.05 154.88 46.24 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.834 1.254 . . . . 0.0 108.999 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.407 ' HB2' HE22 ' A' ' 60' ' ' GLN . 44.4 mm-40 -67.8 -29.6 68.81 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.569 0.543 . . . . 0.0 111.874 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 56.7 p -133.04 161.14 35.15 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 123.43 0.692 . . . . 0.0 111.079 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -54.63 -48.99 71.57 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.117 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -45.37 -46.16 12.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.08 1.752 . . . . 0.0 113.288 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.407 HE22 ' HB2' ' A' ' 56' ' ' GLU . 47.5 mt-30 -70.32 -33.82 71.96 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.11 0.564 . . . . 0.0 112.039 -178.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.511 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -80.42 -38.06 30.93 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.305 0.574 . . . . 0.0 110.753 -174.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -72.1 -40.25 68.31 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.387 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.52 70.94 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.254 0.622 . . . . 0.0 112.118 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -63.81 -57.1 10.94 Favored 'General case' 0 C--N 1.352 0.695 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.89 -46.46 67.98 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.494 1.118 . . . . 0.0 112.223 177.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -60.12 -47.69 84.87 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.41 1.084 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -57.84 -36.28 72.08 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.779 1.232 . . . . 0.0 111.253 177.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -80.96 -25.38 37.41 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.594 0.758 . . . . 0.0 111.011 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.29 -5.55 63.0 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.032 0.349 . . . . 0.0 112.499 -171.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.72 110.62 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.343 0 C-N-CA 123.399 0.68 . . . . 0.0 110.79 -177.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 2' ' ' SER . 1.6 pm0 -54.19 138.91 37.24 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 113.645 -1.616 . . . . 0.0 109.343 169.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -148.21 151.2 35.1 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.0 0.818 . . . . 0.0 112.087 -170.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.511 HH11 HG13 ' A' ' 75' ' ' ILE . 1.2 tmt_? -121.56 125.71 47.41 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.091 0.956 . . . . 0.0 108.651 171.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.447 HG12 ' HB ' ' A' ' 5' ' ' ILE . 33.9 m -93.49 137.88 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.68 0.792 . . . . 0.0 110.315 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.511 HG13 HH11 ' A' ' 73' ' ' ARG . 4.1 mp -121.1 137.32 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.576 1.15 . . . . 0.0 108.325 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.1 mt . . . . . 0 CA--C 1.547 0.854 0 C-N-CA 123.855 0.862 . . . . 0.0 111.469 -178.839 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 m . . . . . 0 N--CA 1.476 0.83 0 N-CA-C 108.791 -0.818 . . . . 0.0 108.791 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.478 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -99.96 129.02 45.99 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.607 0.763 . . . . 0.0 109.973 -177.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -114.6 119.87 38.25 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.988 0.915 . . . . 0.0 108.587 179.103 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.496 HG13 HD13 ' A' ' 25' ' ' LEU . 3.6 mp -106.81 122.69 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -176.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -150.14 161.89 41.51 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.4 0.619 . . . . 0.0 111.73 -172.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 26.0 mtp180 -119.51 103.54 46.49 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.482 168.942 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 61.5 Cg_endo . . . . . 0 CA--C 1.55 1.281 0 C-N-CA 122.265 1.977 . . . . 0.0 112.015 -179.878 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.411 HG21 ' HB ' ' A' ' 54' ' ' THR . 14.7 p . . . . . 0 C--O 1.244 0.8 0 N-CA-C 109.768 -0.456 . . . . 0.0 109.768 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -85.04 127.3 34.16 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -101.43 136.94 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.581 HD23 HD12 ' A' ' 53' ' ' LEU . 58.8 tp -118.26 104.12 10.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.986 1.315 . . . . 0.0 108.715 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.58 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 43.4 mt-10 -104.68 136.92 43.31 Favored 'General case' 0 C--O 1.212 -0.921 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 p90 . . . . . 0 N--CA 1.476 0.844 0 CA-C-N 118.499 0.591 . . . . 0.0 109.918 174.473 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.9 m . . . . . 0 N--CA 1.472 0.671 0 N-CA-C 109.779 -0.452 . . . . 0.0 109.779 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.58 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -135.94 140.27 43.89 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.563 0.696 . . . . 0.0 112.034 -174.151 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 25' ' ' LEU . 50.6 mt -116.81 156.01 27.98 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.609 1.564 . . . . 0.0 107.403 177.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.411 ' HB ' HG21 ' A' ' 22' ' ' VAL . 18.7 p -119.9 133.57 55.53 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.655 -0.653 . . . . 0.0 110.623 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.431 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 96.0 m-85 -135.54 147.67 48.85 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.886 1.275 . . . . 0.0 109.277 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.414 ' HB2' HE22 ' A' ' 60' ' ' GLN . 18.7 mm-40 -67.6 -24.62 65.51 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 123.601 0.563 . . . . 0.0 111.755 -174.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 76.1 p -134.44 163.13 30.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.398 0.679 . . . . 0.0 110.2 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -61.63 -39.5 91.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.471 0.708 . . . . 0.0 110.392 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -52.14 -44.62 64.65 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.747 1.279 . . . . 0.0 112.559 -176.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 48.3 mt-30 -70.97 -30.39 66.65 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.543 0.737 . . . . 0.0 111.976 -177.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.87 -38.61 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.306 0.643 . . . . 0.0 111.301 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -76.09 -39.02 56.27 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.82 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -30.68 71.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 111.695 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -64.42 -53.42 48.62 Favored 'General case' 0 C--N 1.354 0.803 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 174.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.43 -43.93 75.81 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.214 1.005 . . . . 0.0 111.724 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -64.56 -44.57 90.33 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.35 1.06 . . . . 0.0 111.663 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -64.39 -28.78 69.92 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.757 0.823 . . . . 0.0 110.659 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -89.18 -16.84 30.4 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.451 0.7 . . . . 0.0 111.072 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.23 -7.49 81.44 Favored Glycine 0 C--N 1.35 1.335 0 C-N-CA 123.261 0.458 . . . . 0.0 112.89 -176.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.2 mt -59.35 112.01 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 123.233 0.613 . . . . 0.0 110.458 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -55.13 135.83 48.9 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.646 173.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -141.22 144.9 34.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.492 1.042 . . . . 0.0 112.505 -170.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 18.7 tpp180 -116.92 138.11 51.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.52 1.528 . . . . 0.0 108.298 170.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.485 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -105.06 133.34 49.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-O 121.113 0.482 . . . . 0.0 110.328 174.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.3 mp -104.12 112.26 36.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.1 mt . . . . . 0 CA--C 1.543 0.694 0 C-N-CA 123.747 0.819 . . . . 0.0 111.328 -175.793 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 p . . . . . 0 N--CA 1.474 0.758 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.2 138.61 38.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -167.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -107.23 122.04 45.74 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 175.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.507 HG13 HD23 ' A' ' 25' ' ' LEU . 4.3 mp -103.44 122.95 56.64 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -150.15 178.15 9.25 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.426 ' HD2' ' NE1' ' A' ' 23' ' ' TRP . 15.6 ttt180 -136.89 97.14 11.27 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo . . . . . 0 C--N 1.366 1.492 0 C-N-CA 122.913 2.409 . . . . 0.0 113.211 -165.554 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.463 HG21 ' HB ' ' A' ' 54' ' ' THR . 14.1 p . . . . . 0 CA--C 1.544 0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.426 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 67.8 m95 -88.72 131.86 34.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.5 t -101.14 139.88 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.507 HD23 HG13 ' A' ' 5' ' ' ILE . 3.2 tm? -114.64 104.35 11.9 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 105.828 -1.915 . . . . 0.0 105.828 174.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -113.35 131.73 55.85 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.2 p90 . . . . . 0 N--CA 1.476 0.843 0 C-N-CA 123.597 0.759 . . . . 0.0 110.715 178.266 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 46.3 t . . . . . 0 N--CA 1.481 1.122 0 N-CA-C 107.862 -1.162 . . . . 0.0 107.862 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 14.7 ptpt -144.0 139.01 28.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.588 0.708 . . . . 0.0 111.796 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.5 mt -118.47 157.79 26.58 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.469 1.507 . . . . 0.0 108.026 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.463 ' HB ' HG21 ' A' ' 22' ' ' VAL . 34.7 p -119.01 135.09 54.8 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.177 0.591 . . . . 0.0 109.956 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.54 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.9 m-85 -138.38 148.45 44.52 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.206 1.402 . . . . 0.0 109.787 -178.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.432 ' HB2' HE22 ' A' ' 60' ' ' GLN . 35.4 mt-10 -63.14 -32.98 74.49 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.353 0.661 . . . . 0.0 111.896 -174.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.9 p -134.65 164.12 28.22 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.658 0.783 . . . . 0.0 111.274 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.2 -46.1 86.42 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.137 173.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -48.42 -43.81 34.58 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 124.999 1.437 . . . . 0.0 112.811 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.54 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 78.2 mt-30 -70.12 -35.15 73.9 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.529 0.731 . . . . 0.0 111.774 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -76.84 -39.12 52.3 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.491 0.662 . . . . 0.0 110.653 -175.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -30.22 55.43 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.09 -36.0 76.42 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.296 0.639 . . . . 0.0 111.757 173.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -62.2 -58.44 7.76 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.58 -48.09 63.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.948 1.299 . . . . 0.0 112.423 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -61.06 -46.1 92.05 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.318 1.047 . . . . 0.0 111.392 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -59.56 -34.85 73.21 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.536 1.135 . . . . 0.0 111.242 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -87.66 -20.49 26.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.84 0.856 . . . . 0.0 111.587 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.57 -1.93 69.7 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 123.172 0.295 . . . . 0.0 113.143 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.8 mt -59.07 112.24 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.525 0.73 . . . . 0.0 110.939 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -58.0 138.1 56.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.281 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -146.71 148.84 32.41 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 118.719 0.69 . . . . 0.0 112.658 -172.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -114.18 122.96 48.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.007 1.323 . . . . 0.0 108.978 170.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.421 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -91.48 137.06 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.178 0.591 . . . . 0.0 110.007 173.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -122.15 137.18 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.776 1.63 . . . . 0.0 107.817 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.8 mt . . . . . 0 CA--C 1.547 0.828 0 C-N-CA 122.756 0.423 . . . . 0.0 110.242 175.871 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.0 p . . . . . 0 N--CA 1.47 0.546 0 N-CA-C 110.129 -0.323 . . . . 0.0 110.129 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.419 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -99.99 146.25 26.93 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -110.09 124.93 52.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.586 HG12 HD23 ' A' ' 25' ' ' LEU . 71.9 mt -98.41 129.76 48.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.686 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 173.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -152.15 -179.71 7.76 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.401 ' HG3' ' O ' ' A' ' 22' ' ' VAL . 46.7 ttt180 -144.28 95.59 5.5 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 176.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo . . . . . 0 C--N 1.366 1.477 0 C-N-CA 123.082 2.521 . . . . 0.0 112.842 -163.735 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.401 ' O ' ' HG3' ' A' ' 7' ' ' ARG . 31.5 m . . . . . 0 CA--C 1.541 0.608 0 N-CA-C 110.537 -0.171 . . . . 0.0 110.537 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -86.62 136.7 32.95 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.448 0.699 . . . . 0.0 109.153 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.7 t -101.61 139.42 22.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.912 173.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.586 HD23 HG12 ' A' ' 5' ' ' ILE . 2.8 tm? -117.81 104.55 11.07 Favored 'General case' 0 C--N 1.343 0.326 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -107.47 134.32 50.68 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.628 -1.169 . . . . 0.0 107.886 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.4 p90 . . . . . 0 N--CA 1.471 0.58 0 C-N-CA 123.651 0.78 . . . . 0.0 109.555 176.919 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 33.3 m . . . . . 0 N--CA 1.47 0.545 0 N-CA-C 109.093 -0.706 . . . . 0.0 109.093 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.6 pttt -144.87 155.88 43.7 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 121.597 0.713 . . . . 0.0 112.73 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.446 HD12 HD12 ' A' ' 25' ' ' LEU . 43.0 mt -125.39 160.4 29.48 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.74 1.616 . . . . 0.0 108.342 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 15.5 p -118.84 129.41 55.2 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.552 0.741 . . . . 0.0 109.795 172.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.15 147.31 50.55 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.79 1.636 . . . . 0.0 108.169 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -67.28 -31.36 71.62 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.615 0.766 . . . . 0.0 111.227 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 55.2 p -132.41 160.45 36.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.077 0.951 . . . . 0.0 110.112 -177.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -60.45 -40.87 92.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.375 0.67 . . . . 0.0 110.481 171.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -47.33 -47.21 25.82 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 124.497 1.123 . . . . 0.0 112.717 177.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -69.65 -31.03 68.87 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 122.967 0.507 . . . . 0.0 111.761 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.34 -42.99 34.53 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.561 0.744 . . . . 0.0 111.599 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -69.86 -42.68 73.18 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.894 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.65 -32.62 71.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.23 0.612 . . . . 0.0 111.474 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -64.68 -60.01 3.6 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 123.228 0.611 . . . . 0.0 109.533 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.94 -50.22 69.4 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.68 1.192 . . . . 0.0 112.332 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -59.57 -42.24 92.01 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.976 0.91 . . . . 0.0 111.566 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -62.22 -30.57 71.18 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.646 1.178 . . . . 0.0 110.931 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -87.88 -19.53 27.24 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.274 0.63 . . . . 0.0 111.058 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.04 -2.89 66.47 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 112.845 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 45.6 mt -67.14 108.56 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.172 0 CA-C-O 121.274 0.559 . . . . 0.0 110.537 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.44 140.77 57.08 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.845 171.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.419 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 34.5 p90 -142.31 151.63 42.16 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 118.633 0.651 . . . . 0.0 112.032 -169.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -120.42 115.49 23.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.247 1.019 . . . . 0.0 108.441 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -81.83 133.45 29.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.069 0.547 . . . . 0.0 111.1 177.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.02 136.9 51.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 125.721 1.608 . . . . 0.0 107.477 174.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.5 mt . . . . . 0 CA--C 1.546 0.801 0 C-N-CA 123.214 0.606 . . . . 0.0 110.875 179.026 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . 0.422 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 14.6 t . . . . . 0 N--CA 1.482 1.129 0 CA-C-O 120.856 0.36 . . . . 0.0 111.257 . . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.21 137.33 38.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.256 1.022 . . . . 0.0 110.394 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.55 119.98 41.09 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 108.042 175.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.0 mp -105.56 123.5 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 175.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.9 p90 -156.07 172.7 17.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 49.9 ttt180 -136.19 96.97 12.33 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.088 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 78.3 Cg_endo . . . . . 0 C--N 1.36 1.159 0 C-N-CA 122.186 1.924 . . . . 0.0 112.217 -173.047 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 p . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 108.865 -0.791 . . . . 0.0 108.865 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -75.07 123.06 24.52 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 67.8 t -101.48 138.37 25.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 53' ' ' LEU . 52.4 tp -116.06 105.31 12.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 173.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.556 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 16.1 mt-10 -106.58 137.85 43.84 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 172.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.3 p90 . . . . . 0 CA--C 1.502 -0.875 0 CA-C-N 117.571 0.169 . . . . 0.0 110.779 177.736 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m . . . . . 0 C--O 1.241 0.652 0 CA-C-O 121.056 0.455 . . . . 0.0 110.755 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.556 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 3.6 ptpp? -133.21 135.77 45.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.792 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.522 HD12 HD23 ' A' ' 25' ' ' LEU . 42.4 mt -117.47 142.91 46.59 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -114.68 128.95 56.59 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -134.56 156.64 48.31 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.254 1.022 . . . . 0.0 110.133 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -65.14 -31.3 72.42 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.001 0.813 . . . . 0.0 111.466 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 49.6 p -135.62 164.06 28.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.412 0.685 . . . . 0.0 110.965 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.89 -41.73 87.85 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.75 169.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -49.83 -45.74 50.54 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.922 1.389 . . . . 0.0 111.474 -174.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -72.19 -30.03 64.56 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.046 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.511 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -79.48 -40.59 29.4 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.227 0.611 . . . . 0.0 111.067 -176.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -70.78 -39.58 73.1 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.936 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.22 -36.77 66.32 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.739 0.816 . . . . 0.0 112.5 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -66.59 -55.91 13.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.019 0.528 . . . . 0.0 110.299 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.79 -47.09 64.36 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.437 1.095 . . . . 0.0 112.056 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -59.45 -45.24 92.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.091 0.956 . . . . 0.0 111.647 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.5 ttt180 -54.09 -39.39 66.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.737 1.215 . . . . 0.0 111.309 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.98 -27.0 36.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.434 0.694 . . . . 0.0 111.432 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 98.3 1.51 58.03 Favored Glycine 0 C--N 1.349 1.263 0 O-C-N 123.216 0.323 . . . . 0.0 112.592 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.9 mt -69.35 107.25 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 CA-C-O 121.403 0.621 . . . . 0.0 110.201 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.4 pt-20 -54.04 143.94 20.72 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.018 170.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -147.36 149.25 32.43 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.501 1.046 . . . . 0.0 113.026 -168.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -110.76 125.94 54.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.484 1.114 . . . . 0.0 109.928 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 92.4 t -89.89 118.59 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 173.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 77.1 mt -122.6 117.34 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.03 1.332 . . . . 0.0 108.444 -174.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 80.2 mt . . . . . 0 CA--C 1.548 0.9 0 C-N-CA 124.045 0.938 . . . . 0.0 112.239 -174.273 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.8 m . . . . . 0 N--CA 1.474 0.752 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.5 155.38 24.24 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 113.132 0.789 . . . . 0.0 113.132 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -113.05 123.73 50.97 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.062 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.444 HG12 ' HG ' ' A' ' 25' ' ' LEU . 89.9 mt -105.22 127.36 59.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 174.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -148.69 176.5 10.31 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 123.369 0.668 . . . . 0.0 109.434 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 34.1 ttt180 -140.72 95.72 7.77 Favored Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 173.806 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo . . . . . 0 C--N 1.361 1.206 0 C-N-CA 122.968 2.446 . . . . 0.0 114.607 -163.924 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.5 m . . . . . 0 N--CA 1.476 0.874 0 N-CA-C 108.764 -0.828 . . . . 0.0 108.764 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.4 m95 -86.64 125.93 34.17 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.3 t -100.52 136.23 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.444 ' HG ' HG12 ' A' ' 5' ' ' ILE . 5.5 tt -116.07 108.37 16.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 178.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -107.05 135.0 49.35 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 175.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.0 p90 . . . . . 0 N--CA 1.473 0.701 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -175.025 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.4 p . . . . . 0 CA--C 1.552 1.04 0 N-CA-C 110.16 -0.311 . . . . 0.0 110.16 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -135.4 140.79 45.23 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.316 0.579 . . . . 0.0 111.833 -173.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.4 mp -120.47 153.12 37.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.988 1.315 . . . . 0.0 107.887 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.1 p -118.11 133.52 55.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.866 0.466 . . . . 0.0 110.634 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -133.84 147.18 51.17 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.108 1.363 . . . . 0.0 108.512 -177.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.484 ' HB2' HE22 ' A' ' 60' ' ' GLN . 30.7 mm-40 -71.07 -24.53 62.34 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -172.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 81.1 p -136.78 163.2 31.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.647 0.779 . . . . 0.0 109.736 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -64.51 -36.28 83.7 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.757 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -51.0 -48.93 61.25 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.912 0.885 . . . . 0.0 111.613 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.484 HE22 ' HB2' ' A' ' 56' ' ' GLU . 48.7 mt-30 -69.29 -29.36 67.22 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.319 -176.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.4 -41.51 32.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.17 0.588 . . . . 0.0 110.994 177.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.516 ' O ' ' HG3' ' A' ' 66' ' ' GLN . 13.0 pt-20 -77.43 -44.47 28.98 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.426 -169.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.14 69.02 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.414 1.086 . . . . 0.0 112.16 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -64.07 -54.7 29.99 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 172.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.5 -44.87 81.11 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.473 1.109 . . . . 0.0 111.944 178.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . 0.516 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 73.1 mt-30 -60.74 -44.28 96.87 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.105 0.962 . . . . 0.0 110.636 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -62.26 -31.07 71.59 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.005 1.322 . . . . 0.0 111.01 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -87.19 -22.16 25.46 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.051 0.94 . . . . 0.0 110.745 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.29 -1.31 72.96 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.704 -172.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.28 109.86 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-O 121.501 0.667 . . . . 0.0 110.357 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.17 133.94 53.87 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 113.793 -1.549 . . . . 0.0 108.102 171.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 55.7 p90 -140.38 152.68 45.95 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.611 -0.681 . . . . 0.0 110.927 -171.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 tpt85 -118.16 116.46 26.87 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 171.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.9 m -82.28 132.35 31.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-O 121.457 0.646 . . . . 0.0 110.69 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 mp -114.4 136.15 51.91 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.9 mt . . . . . 0 CA--C 1.545 0.776 0 C-N-CA 123.339 0.656 . . . . 0.0 111.863 -178.052 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m . . . . . 0 N--CA 1.479 0.978 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.441 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -100.93 136.95 39.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.946 0.898 . . . . 0.0 109.738 -177.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -115.28 125.29 53.12 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 mp -105.37 121.82 57.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -147.62 172.3 14.25 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.422 ' HD2' ' NE1' ' A' ' 23' ' ' TRP . 38.7 ttt-85 -139.4 94.29 9.6 Favored Pre-proline 0 C--O 1.24 0.567 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 177.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 68.9 Cg_endo . . . . . 0 C--N 1.37 1.707 0 C-N-CA 122.866 2.378 . . . . 0.0 113.537 -168.987 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.9 p . . . . . 0 N--CA 1.476 0.873 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.422 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 77.1 m95 -77.5 116.05 17.76 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 177.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.509 HG22 HG22 ' A' ' 54' ' ' THR . 40.5 t -100.48 139.59 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.441 HD11 ' HB1' ' A' ' 3' ' ' ALA . 47.8 tp -116.24 106.08 13.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.246 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -114.94 133.14 56.26 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.4 p90 . . . . . 0 CA--C 1.505 -0.752 0 C-N-CA 123.807 0.843 . . . . 0.0 109.443 179.285 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.9 m . . . . . 0 N--CA 1.474 0.73 0 N-CA-C 110.079 -0.341 . . . . 0.0 110.079 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -143.82 142.22 30.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.803 0.811 . . . . 0.0 112.28 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.31 159.96 23.96 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.324 1.85 . . . . 0.0 107.281 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.509 HG22 HG22 ' A' ' 24' ' ' VAL . 25.1 p -125.76 131.38 52.52 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.718 0.407 . . . . 0.0 110.743 177.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -129.44 153.61 47.77 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.176 1.391 . . . . 0.0 109.137 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.422 ' HB2' HE22 ' A' ' 60' ' ' GLN . 44.1 mt-10 -70.62 -25.56 63.08 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.008 0.523 . . . . 0.0 112.097 -176.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 71.3 p -134.15 162.56 31.79 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.986 0.422 . . . . 0.0 111.033 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -58.48 -44.56 89.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.863 170.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -54.22 -43.64 70.98 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.652 1.22 . . . . 0.0 112.207 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.422 HE22 ' HB2' ' A' ' 56' ' ' GLU . 48.5 mt-30 -71.07 -30.58 66.75 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.083 0.553 . . . . 0.0 111.813 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -80.41 -38.54 30.04 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.299 0.571 . . . . 0.0 110.859 -177.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -76.34 -37.36 57.43 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.099 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.06 73.34 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.77 0.828 . . . . 0.0 111.722 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -65.8 -51.3 60.18 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.37 74.01 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.383 1.073 . . . . 0.0 111.515 175.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -63.65 -42.94 98.06 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.389 1.076 . . . . 0.0 111.63 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -55.77 -36.83 67.77 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.899 1.279 . . . . 0.0 110.735 175.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.425 ' HB2' HG13 ' A' ' 70' ' ' ILE . 35.0 mmtp -88.62 -19.21 26.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.458 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.27 -3.33 66.33 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-O 119.967 -0.352 . . . . 0.0 112.992 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.425 HG13 ' HB2' ' A' ' 68' ' ' LYS . 22.1 mt -61.61 109.58 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 123.05 0.54 . . . . 0.0 109.569 -178.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.05 139.06 42.55 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 113.544 -1.662 . . . . 0.0 108.79 171.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -140.52 147.4 39.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.414 1.006 . . . . 0.0 112.005 -169.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -122.34 136.67 54.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.841 1.257 . . . . 0.0 108.439 169.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 m -105.69 138.23 31.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.131 0.572 . . . . 0.0 110.246 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.87 136.39 57.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.01 1.724 . . . . 0.0 107.029 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 85.6 mt . . . . . 0 CA--C 1.549 0.934 0 C-N-CA 123.384 0.674 . . . . 0.0 111.345 179.91 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.4 p . . . . . 0 N--CA 1.476 0.86 0 N-CA-C 110.399 -0.223 . . . . 0.0 110.399 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.448 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -99.69 135.65 40.79 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.529 0.732 . . . . 0.0 109.948 -176.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -108.19 126.81 53.22 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.511 ' HB ' HG12 ' A' ' 74' ' ' VAL . 57.0 mt -107.32 120.98 59.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.625 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 173.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -144.86 173.1 12.15 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 59.9 ttt180 -141.38 94.38 7.62 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo . . . . . 0 C--N 1.364 1.369 0 C-N-CA 123.365 2.71 . . . . 0.0 113.021 -169.964 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.403 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 20.9 m . . . . . 0 N--CA 1.481 1.102 0 N-CA-C 110.351 -0.24 . . . . 0.0 110.351 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -85.15 121.71 28.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -177.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.507 HG22 HG22 ' A' ' 54' ' ' THR . 53.1 t -100.21 136.53 31.18 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.448 HD11 ' HB1' ' A' ' 3' ' ' ALA . 56.2 tp -116.77 106.28 13.31 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.878 1.271 . . . . 0.0 108.336 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -112.38 133.7 54.33 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 12.4 p90 . . . . . 0 N--CA 1.474 0.739 0 CA-C-N 118.372 0.533 . . . . 0.0 110.87 -177.34 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 22.2 m . . . . . 0 N--CA 1.471 0.607 0 N-CA-C 109.879 -0.415 . . . . 0.0 109.879 . . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -137.55 147.69 45.34 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.927 0.87 . . . . 0.0 112.309 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.94 156.69 29.11 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 113.721 -1.581 . . . . 0.0 107.136 176.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.507 HG22 HG22 ' A' ' 24' ' ' VAL . 12.2 p -122.76 128.6 50.69 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.419 0.554 . . . . 0.0 110.372 176.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.403 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 97.9 m-85 -128.62 152.15 48.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.379 1.472 . . . . 0.0 108.534 -178.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.408 ' HB2' HE22 ' A' ' 60' ' ' GLN . 49.1 mm-40 -65.96 -33.63 76.27 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.888 0.375 . . . . 0.0 111.302 -179.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 65.1 p -134.33 159.32 41.37 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.52 0.728 . . . . 0.0 110.694 -173.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -58.45 -44.84 89.35 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.54 1.136 . . . . 0.0 111.419 174.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -50.36 -43.11 54.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.322 . . . . 0.0 112.798 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.408 HE22 ' HB2' ' A' ' 56' ' ' GLU . 49.2 mt-30 -70.99 -31.68 68.29 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.013 0.525 . . . . 0.0 111.964 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.53 -40.31 57.16 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.78 0.432 . . . . 0.0 111.088 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -72.45 -33.87 67.35 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.773 177.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.2 -41.25 75.29 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.08 0.552 . . . . 0.0 111.427 173.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -67.08 -58.79 4.22 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 123.314 0.645 . . . . 0.0 110.387 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -50.85 -51.48 50.95 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.79 1.236 . . . . 0.0 112.744 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -63.6 -40.02 95.86 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.698 0.799 . . . . 0.0 111.816 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -54.45 -37.15 64.85 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.615 1.166 . . . . 0.0 110.855 174.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.548 ' HB2' HG13 ' A' ' 70' ' ' ILE . 33.0 mmtp -90.43 -20.06 23.19 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.497 0.719 . . . . 0.0 111.686 -178.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.57 1.86 60.28 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-O 119.891 -0.394 . . . . 0.0 113.14 -176.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.548 HG13 ' HB2' ' A' ' 68' ' ' LYS . 10.7 mt -64.25 108.71 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-O 120.956 0.408 . . . . 0.0 110.439 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -56.43 139.2 49.78 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.152 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -148.14 153.09 38.37 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.794 0.724 . . . . 0.0 111.179 -170.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . 0.43 ' NH1' HG13 ' A' ' 75' ' ' ILE . 6.2 tmm_? -133.92 146.81 50.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 169.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.511 HG12 ' HB ' ' A' ' 5' ' ' ILE . 19.8 m -106.36 140.91 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.746 0.784 . . . . 0.0 111.747 -173.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.43 HG13 ' NH1' ' A' ' 73' ' ' ARG . 3.3 mp -109.35 141.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 125.803 1.641 . . . . 0.0 107.088 173.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.6 mt . . . . . 0 CA--C 1.552 1.042 0 C-N-CA 122.761 0.424 . . . . 0.0 111.531 179.171 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 p . . . . . 0 N--CA 1.475 0.786 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.63 137.12 39.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.909 0.484 . . . . 0.0 111.189 -166.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.85 132.11 54.45 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 58' ' ' GLN . 40.2 mt -112.57 123.98 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.45 175.29 12.0 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 40.7 ttt-85 -136.74 97.17 11.45 Favored Pre-proline 0 N--CA 1.479 0.992 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo . . . . . 0 C--N 1.371 1.717 0 C-N-CA 123.253 2.635 . . . . 0.0 112.638 -170.745 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.445 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 16.8 m . . . . . 0 N--CA 1.478 0.946 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 . . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -86.94 130.32 34.51 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -177.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.1 t -101.29 137.54 28.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 54.2 tp -115.27 105.09 12.47 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 177.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -118.58 130.17 55.74 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.2 p90 . . . . . 0 N--CA 1.475 0.786 0 CA-C-N 118.401 0.546 . . . . 0.0 111.561 -173.875 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 29.8 m . . . . . 0 C--O 1.241 0.625 0 N-CA-C 109.491 -0.559 . . . . 0.0 109.491 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.61 150.48 37.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.336 1.065 . . . . 0.0 113.361 -173.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -121.68 159.15 27.14 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 113.532 -1.667 . . . . 0.0 107.599 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 p -122.28 129.87 52.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.081 0.953 . . . . 0.0 110.309 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.462 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 94.9 m-85 -130.54 148.93 52.4 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.268 1.427 . . . . 0.0 108.171 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.99 -29.65 70.07 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 120.906 0.384 . . . . 0.0 110.477 -176.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.8 p -133.07 159.66 39.44 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.2 1.0 . . . . 0.0 110.134 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.472 ' HG3' HG21 ' A' ' 5' ' ' ILE . 41.0 tt0 -59.99 -41.17 91.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.7 0.8 . . . . 0.0 110.864 171.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -50.48 -45.57 56.37 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 124.559 1.162 . . . . 0.0 112.201 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.462 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 48.8 mt-30 -67.32 -32.54 73.57 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.178 0.591 . . . . 0.0 111.385 -178.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.18 -42.95 54.73 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.058 0.543 . . . . 0.0 111.459 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -75.08 -39.22 60.94 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.844 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.29 71.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.518 0.727 . . . . 0.0 111.661 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . 0.507 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 14.9 t80 -66.91 -56.64 9.39 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.83 -45.66 70.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.086 0.954 . . . . 0.0 112.529 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -62.03 -43.93 97.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.487 1.115 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -57.23 -34.52 68.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.703 1.201 . . . . 0.0 111.646 176.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.63 ' HB2' HG13 ' A' ' 70' ' ' ILE . 11.7 mmmm -92.22 -16.88 25.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.13 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 88.48 1.5 80.85 Favored Glycine 0 C--N 1.35 1.35 0 O-C-N 123.616 0.573 . . . . 0.0 112.849 -173.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.63 HG13 ' HB2' ' A' ' 68' ' ' LYS . 73.0 mt -57.95 114.94 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.259 0.623 . . . . 0.0 110.988 -179.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -57.61 131.2 49.51 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 113.942 -1.481 . . . . 0.0 108.543 169.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.7 p90 -144.01 147.97 34.61 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-O 121.272 0.558 . . . . 0.0 111.43 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -117.6 123.06 45.26 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.343 172.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.9 t -80.19 124.2 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 170.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -107.87 120.44 59.23 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 169.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.3 mt . . . . . 0 CA--C 1.544 0.748 0 O-C-N 123.185 0.303 . . . . 0.0 110.28 176.662 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 m . . . . . 0 N--CA 1.473 0.69 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.456 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -100.89 123.79 45.61 Favored 'General case' 0 C--O 1.218 -0.589 0 C-N-CA 123.146 0.578 . . . . 0.0 109.899 -172.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -107.18 119.26 38.91 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 91.5 mt -105.09 121.19 56.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.439 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.7 p90 -152.15 177.49 10.47 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 21.7 ttt180 -143.52 97.5 5.52 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.623 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo . . . . . 0 C--N 1.371 1.745 0 C-N-CA 122.675 2.25 . . . . 0.0 112.085 -174.913 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.4 p . . . . . 0 C--O 1.246 0.914 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -85.3 133.39 34.15 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.3 t -102.31 137.24 30.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 2.8 tt -115.72 106.61 14.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 175.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -116.89 131.17 57.02 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 -177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.456 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 43.1 p90 . . . . . 0 C--O 1.242 0.698 0 C-N-CA 123.334 0.654 . . . . 0.0 110.522 179.583 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.6 p . . . . . 0 N--CA 1.477 0.918 0 N-CA-C 108.951 -0.759 . . . . 0.0 108.951 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 14.5 ptpt -137.75 133.11 33.72 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.592 0.711 . . . . 0.0 112.233 -175.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.4 mp -119.45 151.09 39.13 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.191 1.396 . . . . 0.0 107.652 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.2 p -118.26 132.54 56.3 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 118.564 0.62 . . . . 0.0 111.243 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -132.7 149.53 52.28 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.247 1.419 . . . . 0.0 108.938 -177.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.413 ' HB2' HE22 ' A' ' 60' ' ' GLN . 40.3 mt-10 -68.91 -28.19 66.45 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.936 0.494 . . . . 0.0 111.901 -176.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.0 p -134.64 162.14 33.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.442 0.697 . . . . 0.0 110.909 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.74 -43.0 98.46 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.622 0.769 . . . . 0.0 111.011 171.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -57.1 -37.5 72.03 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.225 0.953 . . . . 0.0 111.779 -175.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.413 HE22 ' HB2' ' A' ' 56' ' ' GLU . 48.4 mt-30 -72.91 -32.81 65.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.999 0.52 . . . . 0.0 111.442 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.73 -39.06 57.88 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 -177.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.11 -32.29 63.15 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.952 176.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.67 -37.91 66.33 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.359 0.663 . . . . 0.0 111.693 174.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -65.34 -59.78 3.67 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.643 0.777 . . . . 0.0 110.416 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.88 70.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.394 1.077 . . . . 0.0 112.767 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -63.01 -39.71 95.56 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.162 0.985 . . . . 0.0 111.287 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -53.82 -38.22 64.38 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.316 1.046 . . . . 0.0 111.322 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . 0.461 ' HB2' HG13 ' A' ' 70' ' ' ILE . 79.7 mttt -93.27 -18.03 22.94 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.921 -176.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.69 6.76 76.19 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.195 -172.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . 0.461 HG13 ' HB2' ' A' ' 68' ' ' LYS . 67.7 mt -60.5 113.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -56.62 129.97 43.26 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.111 -1.858 . . . . 0.0 108.666 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -141.17 140.23 34.0 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.692 -0.63 . . . . 0.0 111.746 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.2 tpp85 -104.74 122.99 46.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.692 1.197 . . . . 0.0 108.937 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.1 t -85.12 125.88 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.439 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.7 mp -108.41 125.35 65.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 C-N-CA 125.397 1.479 . . . . 0.0 107.107 170.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.7 mt . . . . . 0 CA--C 1.545 0.772 0 C-N-CA 122.288 0.235 . . . . 0.0 111.092 179.386 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.2 p . . . . . 0 N--CA 1.478 0.955 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.469 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -98.02 145.07 26.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.055 -172.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -113.84 125.28 53.9 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 168.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.519 ' HB ' HG12 ' A' ' 74' ' ' VAL . 91.6 mt -107.07 121.49 59.98 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.452 ' HA ' ' O ' ' A' ' 75' ' ' ILE . 30.5 p90 -149.1 174.91 11.82 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -126.26 99.95 30.27 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 175.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 72.3 Cg_endo . . . . . 0 C--N 1.368 1.578 0 C-N-CA 123.022 2.481 . . . . 0.0 112.865 -172.501 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.42 ' O ' ' HD2' ' A' ' 8' ' ' PRO . 27.0 m . . . . . 0 N--CA 1.473 0.71 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 . . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -87.96 125.89 34.76 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 118.819 0.736 . . . . 0.0 109.448 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 76.1 t -101.39 138.97 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.412 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 9.4 tt -115.22 107.21 14.99 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -116.37 130.4 56.75 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 45.1 p90 . . . . . 0 CA--C 1.509 -0.623 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 -175.955 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.5 t . . . . . 0 N--CA 1.482 1.165 0 N-CA-C 112.33 0.493 . . . . 0.0 112.33 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 13.2 ptmm? -131.88 136.82 47.72 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.223 171.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.3 mp -120.12 144.63 47.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 19.2 p -111.8 128.86 56.24 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.085 0.554 . . . . 0.0 109.806 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -125.3 156.56 38.45 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 125.05 1.34 . . . . 0.0 108.943 -178.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.36 -42.0 97.99 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.246 1.018 . . . . 0.0 111.696 177.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.0 p -136.5 168.11 20.1 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 124.013 0.925 . . . . 0.0 110.014 -173.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -63.33 -37.38 87.04 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.484 173.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -58.55 -41.24 85.15 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 124.148 0.905 . . . . 0.0 111.815 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -70.36 -29.51 66.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.978 0.511 . . . . 0.0 111.817 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.72 -41.22 38.56 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.088 0.555 . . . . 0.0 110.747 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.52 -38.66 65.25 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.648 -177.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.78 -36.12 73.91 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 0.0 112.02 172.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -64.61 -58.26 6.82 Favored 'General case' 0 C--N 1.349 0.548 0 O-C-N 123.68 0.612 . . . . 0.0 110.011 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.55 -50.06 66.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.607 1.163 . . . . 0.0 112.382 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -60.59 -42.33 96.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.672 0.789 . . . . 0.0 111.163 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -61.93 -30.34 70.84 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.773 1.229 . . . . 0.0 111.152 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.61 -14.29 26.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.291 0.636 . . . . 0.0 111.274 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.39 2.03 83.13 Favored Glycine 0 C--N 1.351 1.374 0 O-C-N 123.15 0.281 . . . . 0.0 113.018 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.1 mt -62.23 111.91 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 CA-C-O 121.522 0.677 . . . . 0.0 111.121 178.72 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -61.23 133.31 55.78 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 113.434 -1.712 . . . . 0.0 108.528 169.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 53.7 p90 -138.77 143.59 39.03 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.055 0.843 . . . . 0.0 112.652 -171.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -110.19 110.57 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.912 1.285 . . . . 0.0 108.567 173.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.519 HG12 ' HB ' ' A' ' 5' ' ' ILE . 27.3 m -83.88 128.94 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' A' ' 6' ' ' TYR . 4.2 mp -119.55 126.37 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 172.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 45.3 mt . . . . . 0 CA--C 1.546 0.811 0 CA-C-O 119.298 -0.382 . . . . 0.0 110.247 177.984 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 p . . . . . 0 N--CA 1.475 0.791 0 N-CA-C 110.376 -0.231 . . . . 0.0 110.376 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.83 139.24 36.8 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.328 0.651 . . . . 0.0 110.111 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -107.46 127.32 53.5 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.433 HG21 ' HG3' ' A' ' 58' ' ' GLN . 61.1 mt -107.09 122.94 61.87 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -147.19 176.58 9.86 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.6 ttt180 -141.52 96.02 7.05 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 175.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 74.6 Cg_endo . . . . . 0 C--N 1.365 1.44 0 C-N-CA 122.842 2.361 . . . . 0.0 112.754 -170.66 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . 0.446 HG21 ' HB ' ' A' ' 54' ' ' THR . 3.6 m . . . . . 0 C--O 1.244 0.782 0 CA-C-O 121.139 0.495 . . . . 0.0 110.793 . . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -84.06 122.21 28.48 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . 0.5 HG22 HG22 ' A' ' 54' ' ' THR . 56.0 t -100.93 138.72 24.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.53 -177.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -117.43 105.06 11.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -117.11 130.18 56.46 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.3 p90 . . . . . 0 CA--C 1.51 -0.577 0 C-N-CA 123.105 0.562 . . . . 0.0 110.224 -177.28 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 31.0 m . . . . . 0 N--CA 1.474 0.757 0 CA-C-O 120.963 0.411 . . . . 0.0 111.022 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -146.17 142.84 28.85 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.164 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp -116.77 158.58 23.66 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.819 1.648 . . . . 0.0 108.106 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . 0.5 HG22 HG22 ' A' ' 24' ' ' VAL . 17.0 p -122.84 133.87 54.42 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.656 0.782 . . . . 0.0 110.973 175.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . 0.401 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 98.8 m-85 -135.15 153.06 52.11 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.277 1.031 . . . . 0.0 109.897 -178.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.476 ' HB2' HE22 ' A' ' 60' ' ' GLN . 6.2 mm-40 -62.85 -32.42 73.64 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.26 0.624 . . . . 0.0 111.356 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 34.6 p -135.5 162.11 33.6 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.734 0.814 . . . . 0.0 111.127 -174.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . 0.433 ' HG3' HG21 ' A' ' 5' ' ' ILE . 41.6 tt0 -58.43 -41.9 86.09 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.705 170.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -49.36 -47.7 47.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.137 1.375 . . . . 0.0 112.563 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.476 HE22 ' HB2' ' A' ' 56' ' ' GLU . 50.9 mt-30 -69.32 -30.73 68.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.458 0.703 . . . . 0.0 111.7 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.6 -42.51 51.73 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.893 0.477 . . . . 0.0 111.139 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -72.18 -39.27 68.78 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.455 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.37 74.96 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 122.775 0.43 . . . . 0.0 111.956 176.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -66.13 -56.58 10.73 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.26 -48.71 68.03 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.468 1.107 . . . . 0.0 111.903 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -64.66 -40.42 95.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.821 0.848 . . . . 0.0 111.514 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -56.09 -35.51 67.11 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.928 1.291 . . . . 0.0 111.081 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -85.75 -23.11 27.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.789 0.836 . . . . 0.0 110.844 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.56 -0.75 65.7 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-O 120.089 -0.284 . . . . 0.0 112.415 -172.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 50.9 mt -65.44 108.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.09 139.75 40.45 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.173 -1.831 . . . . 0.0 108.74 169.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -136.58 145.59 45.13 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 118.866 0.757 . . . . 0.0 111.657 -171.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -118.21 130.0 55.82 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.703 1.201 . . . . 0.0 108.438 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 48.6 t -102.43 132.52 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 121.81 67.81 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.9 mt . . . . . 0 CA--C 1.545 0.761 0 C-N-CA 122.777 0.431 . . . . 0.0 111.265 -179.592 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.9 m . . . . . 0 N--CA 1.467 0.398 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.85 127.62 44.83 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -169.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -109.5 122.1 46.66 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.483 HG13 HD23 ' A' ' 25' ' ' LEU . 3.6 mp -103.6 119.79 52.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . 0.427 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 42.8 p90 -143.84 176.45 9.24 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . 0.431 ' HD2' ' NE1' ' A' ' 23' ' ' TRP . 78.2 ttt180 -142.68 100.81 5.53 Favored Pre-proline 0 C--N 1.314 -0.954 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo . . . . . 0 C--N 1.368 1.568 0 C-N-CA 122.089 1.859 . . . . 0.0 110.625 -177.193 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.7 m . . . . . 0 C--O 1.245 0.864 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . 0.431 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 66.4 m95 -90.35 131.83 35.92 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.856 0.862 . . . . 0.0 109.039 -176.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -100.08 139.3 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.257 177.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 53' ' ' LEU . 3.4 tm? -111.34 105.2 13.78 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 175.001 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . 0.654 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 1.8 tm-20 -116.25 124.44 50.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 -174.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.6 p90 . . . . . 0 N--CA 1.472 0.66 0 CA-C-N 119.317 0.962 . . . . 0.0 111.667 -174.835 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 32.1 m . . . . . 0 N--CA 1.475 0.782 0 CA-C-O 120.941 0.4 . . . . 0.0 110.825 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.654 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 4.5 ptpp? -133.72 142.7 48.08 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.234 1.016 . . . . 0.0 112.356 -171.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 25' ' ' LEU . 48.9 mt -118.56 154.0 33.31 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.944 1.698 . . . . 0.0 107.213 177.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 p -121.36 130.91 53.88 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.06 0.845 . . . . 0.0 110.134 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -129.1 153.49 47.61 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.836 1.655 . . . . 0.0 108.549 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.407 ' HB2' HE22 ' A' ' 60' ' ' GLN . 24.3 mm-40 -67.0 -32.9 74.45 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.789 0.436 . . . . 0.0 111.835 -179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.5 p -134.69 160.61 37.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.415 0.686 . . . . 0.0 111.226 -175.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -58.84 -45.53 89.84 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.224 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -50.42 -42.43 53.87 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.635 1.174 . . . . 0.0 112.831 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.407 HE22 ' HB2' ' A' ' 56' ' ' GLU . 47.6 mt-30 -71.26 -30.89 66.85 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.173 0.589 . . . . 0.0 112.17 -178.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.41 -39.79 24.41 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.413 0.685 . . . . 0.0 111.188 -178.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -76.37 -39.87 52.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 114.636 -1.165 . . . . 0.0 111.229 -178.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.91 -25.88 65.71 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.423 0.689 . . . . 0.0 111.599 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -65.36 -52.44 53.68 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.05 -46.47 75.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.089 0.956 . . . . 0.0 111.415 176.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -58.73 -47.44 84.59 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.424 1.09 . . . . 0.0 111.222 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.0 ttm-85 -59.46 -32.46 70.26 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.136 1.375 . . . . 0.0 111.576 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -94.54 -12.2 28.04 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.422 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.97 -4.97 81.94 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-O 119.921 -0.377 . . . . 0.0 112.732 -178.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.44 113.65 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.947 0 C-N-CA 123.656 0.782 . . . . 0.0 110.883 -177.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -55.82 134.17 51.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 113.433 -1.712 . . . . 0.0 108.648 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -143.06 149.8 38.69 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 118.237 0.471 . . . . 0.0 110.81 -174.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -133.51 141.17 47.63 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 171.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.474 HG12 ' HB ' ' A' ' 5' ' ' ILE . 18.0 m -103.86 139.97 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-O 121.131 0.491 . . . . 0.0 111.18 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . 0.427 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.4 mp -109.29 121.94 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 171.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 mt . . . . . 0 CA--C 1.55 0.979 0 C-N-CA 122.77 0.428 . . . . 0.0 111.169 -179.232 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 t . . . . . 0 N--CA 1.472 0.672 0 N-CA-C 108.193 -1.039 . . . . 0.0 108.193 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.94 156.15 24.44 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -173.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -113.0 126.36 55.42 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.924 1.29 . . . . 0.0 109.099 164.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.1 mt -103.21 129.6 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 171.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -154.03 -179.14 7.6 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 123.857 0.863 . . . . 0.0 109.552 176.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 37.1 ttt180 -141.39 99.36 6.43 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 106.957 -1.497 . . . . 0.0 106.957 174.254 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 56.1 Cg_endo . . . . . 0 C--N 1.368 1.572 0 C-N-CA 122.713 2.275 . . . . 0.0 112.523 -172.021 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.1 p . . . . . 0 C--O 1.245 0.844 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -75.93 125.8 29.8 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -173.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 90.9 t -102.07 139.22 23.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.11 105.97 13.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 169.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -104.32 133.35 49.36 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 27.9 p90 . . . . . 0 N--CA 1.474 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.019 -175.278 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.6 m . . . . . 0 N--CA 1.474 0.744 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 23.5 pttm -144.14 148.33 34.91 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.93 0.871 . . . . 0.0 113.263 -167.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.7 mp -120.99 155.65 33.83 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.85 -1.523 . . . . 0.0 107.855 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -118.15 130.66 56.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.348 0.659 . . . . 0.0 110.252 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.75 153.05 48.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.358 1.463 . . . . 0.0 109.206 -175.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.432 ' HB2' HE22 ' A' ' 60' ' ' GLN . 14.7 mm-40 -72.01 -29.86 64.63 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.187 0.595 . . . . 0.0 111.745 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.9 p -136.44 163.42 30.52 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.431 0.692 . . . . 0.0 110.758 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -57.5 -44.58 85.12 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.796 0.838 . . . . 0.0 110.615 172.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 41.8 mt-10 -56.61 -39.09 72.99 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 124.677 1.235 . . . . 0.0 111.969 -174.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.432 HE22 ' HB2' ' A' ' 56' ' ' GLU . 78.6 mt-30 -64.04 -39.66 94.57 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.484 0.714 . . . . 0.0 111.541 175.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.4 -40.05 62.27 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.302 0.641 . . . . 0.0 111.768 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . 0.514 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.7 pt-20 -76.82 -43.01 38.18 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.135 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.99 -27.21 65.49 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 123.168 0.587 . . . . 0.0 111.431 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -64.21 -54.31 35.48 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 172.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.33 -48.41 74.22 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.586 1.154 . . . . 0.0 111.833 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -60.7 -43.9 97.21 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.421 1.088 . . . . 0.0 111.432 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -64.0 -28.1 69.58 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.587 1.155 . . . . 0.0 111.552 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.87 -13.53 27.1 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.264 0.626 . . . . 0.0 111.116 177.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.02 -1.12 82.8 Favored Glycine 0 C--N 1.354 1.529 0 O-C-N 123.332 0.395 . . . . 0.0 113.252 -176.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.8 mt -63.17 110.67 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.294 0 CA-C-O 121.836 0.827 . . . . 0.0 110.807 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -65.68 137.28 57.21 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.352 -1.749 . . . . 0.0 109.137 171.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -140.44 149.76 42.98 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.669 0.668 . . . . 0.0 112.486 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -108.52 111.59 23.53 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.164 0.986 . . . . 0.0 109.5 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 76.7 t -79.64 118.22 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.477 0.711 . . . . 0.0 109.819 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 27.6 mt -122.86 97.48 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.438 1.495 . . . . 0.0 107.495 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.8 mt . . . . . 0 CA--C 1.554 1.109 0 C-N-CA 123.264 0.626 . . . . 0.0 112.386 -173.831 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m . . . . . 0 N--CA 1.474 0.745 0 N-CA-C 109.078 -0.712 . . . . 0.0 109.078 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 3' ' ' ALA . . . . . 0.487 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.28 128.84 47.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.234 0.614 . . . . 0.0 109.998 -174.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -109.04 123.79 49.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 176.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 5' ' ' ILE . . . . . 0.544 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.7 mp -109.17 121.14 61.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -148.42 170.87 17.05 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -172.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 58.0 ttt180 -139.36 96.3 8.86 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo . . . . . 0 C--N 1.371 1.76 0 C-N-CA 122.488 2.125 . . . . 0.0 112.023 -173.351 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.3 m . . . . . 0 N--CA 1.48 1.057 0 CA-C-O 120.588 0.232 . . . . 0.0 110.614 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -88.79 129.1 35.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.414 1.085 . . . . 0.0 108.86 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -101.35 137.28 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.429 HD21 ' HB1' ' A' ' 3' ' ' ALA . 5.6 tt -112.45 108.56 17.74 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 175.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -114.14 132.7 55.98 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' PHE . . . . . 0.487 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 3.3 p90 . . . . . 0 C--O 1.241 0.643 0 CA-C-O 121.555 0.693 . . . . 0.0 112.615 -178.318 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.2 t . . . . . 0 N--CA 1.478 0.969 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 6.5 ptpp? -138.8 134.48 33.46 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.331 172.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.24 159.88 18.87 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.952 1.301 . . . . 0.0 107.749 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -125.82 129.82 50.16 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.17 0.509 . . . . 0.0 110.118 170.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -127.04 150.36 49.48 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.547 1.539 . . . . 0.0 108.734 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' GLU . . . . . 0.421 ' HB2' HE22 ' A' ' 60' ' ' GLN . 43.8 mt-10 -72.43 -26.15 61.74 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.412 0.685 . . . . 0.0 111.763 -176.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.1 p -130.34 159.78 35.93 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.453 0.701 . . . . 0.0 109.619 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -62.71 -39.26 93.47 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.495 171.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -55.33 -41.12 72.02 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.367 1.042 . . . . 0.0 111.874 -176.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' GLN . . . . . 0.421 HE22 ' HB2' ' A' ' 56' ' ' GLU . 48.9 mt-30 -68.21 -32.78 73.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.099 0.56 . . . . 0.0 111.395 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.45 -41.44 21.82 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.506 0.723 . . . . 0.0 111.326 -175.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.39 -38.91 74.76 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.843 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.36 71.09 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.159 0.584 . . . . 0.0 112.078 175.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -63.33 -59.15 5.09 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.73 73.7 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.12 0.968 . . . . 0.0 111.662 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -65.86 -42.65 90.16 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.178 0.991 . . . . 0.0 111.799 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -55.66 -38.34 69.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.566 1.146 . . . . 0.0 110.684 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -80.77 -26.41 37.27 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.823 0.849 . . . . 0.0 110.754 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.86 -5.26 69.07 Favored Glycine 0 C--N 1.349 1.301 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.541 -169.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.68 112.13 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-O 121.437 0.637 . . . . 0.0 110.644 -178.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.95 135.34 36.82 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 113.149 -1.841 . . . . 0.0 108.821 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -143.04 145.93 33.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.428 0.558 . . . . 0.0 111.207 -170.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -125.64 114.01 18.14 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' VAL . . . . . 0.544 HG12 ' HB ' ' A' ' 5' ' ' ILE . 24.5 m -84.53 139.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.92 0.488 . . . . 0.0 111.077 177.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.83 126.29 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.469 1.508 . . . . 0.0 107.412 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.8 mt . . . . . 0 CA--C 1.551 0.983 0 C-N-CA 122.927 0.491 . . . . 0.0 110.535 177.943 . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.485 1.277 0 N-CA-C 109.008 -0.738 . . . . 0.0 109.008 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.6 p -106.87 124.0 48.98 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 122.99 0.516 . . . . 0.0 110.776 -175.955 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.53 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -102.6 127.53 49.65 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.844 0.858 . . . . 0.0 109.172 175.734 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.409 ' HB2' HD13 ' A' ' 75' ' ' ILE . 17.2 ptpt -108.72 124.23 50.23 Favored 'General case' 0 CA--C 1.542 0.65 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 -177.833 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.462 HG13 HD13 ' A' ' 25' ' ' LEU . 4.0 mp -107.87 121.24 60.55 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.733 0 N-CA-C 107.064 -1.458 . . . . 0.0 107.064 -179.789 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.483 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.9 p90 -150.59 160.05 44.08 Favored 'General case' 0 N--CA 1.474 0.742 0 CA-C-O 121.429 0.633 . . . . 0.0 112.132 -173.483 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.585 ' HB2' ' HB3' ' A' ' 77' ' ' PRO . 11.9 mtp180 -122.16 96.61 46.3 Favored Pre-proline 0 N--CA 1.478 0.97 0 N-CA-C 107.081 -1.451 . . . . 0.0 107.081 168.256 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.57 ' HG2' ' HA ' ' A' ' 11' ' ' THR . 73.1 Cg_endo -74.8 165.34 31.68 Favored 'Trans proline' 0 CA--C 1.552 1.424 0 C-N-CA 122.623 2.215 . . . . 0.0 111.676 178.297 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.71 -41.19 99.02 Favored 'General case' 0 N--CA 1.482 1.128 0 C-N-CA 123.72 0.808 . . . . 0.0 110.466 177.881 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.8 ptmt -112.72 112.26 23.64 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 107.678 -1.231 . . . . 0.0 107.678 170.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.57 ' HA ' ' HG2' ' A' ' 8' ' ' PRO . 7.8 p -93.29 154.55 17.93 Favored 'General case' 0 N--CA 1.478 0.942 0 C-N-CA 123.685 0.794 . . . . 0.0 111.948 -170.682 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -68.03 96.54 0.62 Allowed 'General case' 0 C--N 1.354 0.769 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 171.251 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.491 ' HA ' ' HB3' ' A' ' 18' ' ' ALA . 57.2 mtt -73.11 -25.48 60.88 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 115.12 -0.946 . . . . 0.0 111.101 -174.899 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 56.73 87.93 0.05 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 125.016 1.326 . . . . 0.0 111.095 174.735 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.1 t 63.71 17.41 10.43 Favored 'General case' 0 CA--C 1.558 1.254 0 C-N-CA 124.165 0.986 . . . . 0.0 111.314 -174.928 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.22 28.85 73.15 Favored Glycine 0 C--N 1.354 1.568 0 CA-C-N 115.957 -0.565 . . . . 0.0 113.787 -178.233 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 76.4 p -82.71 -41.83 18.8 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 122.743 0.417 . . . . 0.0 111.561 -177.76 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.491 ' HB3' ' HA ' ' A' ' 13' ' ' MET . . . -66.61 134.89 53.25 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.593 0.757 . . . . 0.0 111.515 -177.318 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 74.2 mmtt -93.68 -72.08 0.63 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.798 0.839 . . . . 0.0 109.559 -177.327 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 30.0 p -81.43 -179.82 7.53 Favored 'General case' 0 C--O 1.244 0.771 0 C-N-CA 123.671 0.788 . . . . 0.0 110.354 177.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.449 ' HA ' HG21 ' A' ' 11' ' ' THR . 13.3 m120 -66.97 92.21 0.23 Allowed 'General case' 0 CA--C 1.541 0.625 0 CA-C-O 121.344 0.592 . . . . 0.0 109.832 176.437 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 13.7 p -71.06 153.19 8.4 Favored 'Isoleucine or valine' 0 C--O 1.249 1.076 0 CA-C-N 115.162 -0.926 . . . . 0.0 109.169 175.799 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.412 ' CH2' ' HD3' ' A' ' 77' ' ' PRO . 75.7 m95 -82.51 125.43 31.11 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 107.097 -1.445 . . . . 0.0 107.097 177.284 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 34.9 t -100.07 135.97 33.45 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.569 0 N-CA-C 107.21 -1.404 . . . . 0.0 107.21 177.952 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.53 HD11 ' HB1' ' A' ' 3' ' ' ALA . 51.2 tp -116.37 104.0 11.03 Favored 'General case' 0 C--N 1.333 -0.149 0 N-CA-C 107.461 -1.311 . . . . 0.0 107.461 179.136 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.408 ' O ' ' HG2' ' A' ' 4' ' ' LYS . 36.6 tt0 -104.97 135.92 45.41 Favored 'General case' 0 C--O 1.214 -0.772 0 N-CA-C 107.004 -1.48 . . . . 0.0 107.004 176.841 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 28.6 p90 -142.62 153.68 43.7 Favored 'General case' 0 C--O 1.239 0.537 0 CA-C-N 118.559 0.618 . . . . 0.0 111.876 -178.642 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.0 t70 -61.42 86.84 0.02 OUTLIER 'General case' 0 CA--C 1.542 0.64 0 CA-C-N 114.499 -1.228 . . . . 0.0 110.025 165.612 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.48 ' HB2' HG22 ' A' ' 51' ' ' VAL . . . -77.67 111.92 13.95 Favored 'General case' 0 C--O 1.239 0.541 0 CA-C-N 115.007 -0.997 . . . . 0.0 109.284 177.597 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -71.77 113.12 8.47 Favored 'General case' 0 CA--C 1.544 0.75 0 CA-C-N 115.743 -0.662 . . . . 0.0 110.734 -177.183 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 3.2 p -103.59 95.96 8.08 Favored Pre-proline 0 CA--C 1.556 1.179 0 N-CA-C 106.797 -1.557 . . . . 0.0 106.797 167.027 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -70.97 -163.57 0.13 Allowed 'Trans proline' 0 C--N 1.38 2.226 0 C-N-CA 123.314 2.676 . . . . 0.0 113.11 -171.629 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.4 ptp180 -61.06 98.03 0.07 Allowed 'General case' 0 CA--C 1.551 0.987 0 CA-C-O 122.446 1.117 . . . . 0.0 110.236 176.464 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.6 mmmt -149.34 80.37 1.4 Allowed 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 125.0 1.32 . . . . 0.0 108.545 -169.11 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 2.9 pp -82.41 154.42 3.97 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 CA-C-N 115.857 -0.611 . . . . 0.0 109.917 173.705 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.7 t70 -85.38 132.01 46.26 Favored Pre-proline 0 N--CA 1.474 0.746 0 N-CA-C 108.419 -0.956 . . . . 0.0 108.419 176.875 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 29.5 Cg_endo -59.76 -27.15 84.27 Favored 'Trans proline' 0 C--N 1.372 1.78 0 C-N-CA 122.939 2.426 . . . . 0.0 113.469 179.294 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 29.3 mm -74.66 -42.2 48.07 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.058 0 CA-C-O 121.338 0.59 . . . . 0.0 109.856 179.706 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 57.7 mtt -85.72 -18.57 32.71 Favored 'General case' 0 N--CA 1.479 1.001 0 CA-C-N 115.1 -0.955 . . . . 0.0 111.557 -174.199 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.31 -124.66 30.24 Favored Glycine 0 C--N 1.349 1.282 0 O-C-N 123.463 0.477 . . . . 0.0 112.349 -178.727 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 53.4 m-85 -73.84 105.8 5.28 Favored 'General case' 0 N--CA 1.471 0.586 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 173.044 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 2.9 t -125.51 103.66 8.0 Favored 'General case' 0 CA--C 1.543 0.694 0 C-N-CA 123.746 0.818 . . . . 0.0 109.975 -178.889 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.5 t -68.12 -20.56 64.93 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 123.602 0.761 . . . . 0.0 110.584 173.162 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.4 t -76.44 78.27 3.16 Favored 'General case' 0 C--N 1.355 0.818 0 CA-C-O 121.838 0.828 . . . . 0.0 109.569 174.665 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.0 t -165.36 93.91 0.61 Allowed 'General case' 0 C--O 1.242 0.678 0 N-CA-C 106.76 -1.57 . . . . 0.0 106.76 179.099 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 15.0 t70 -62.93 148.32 47.78 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.304 0.642 . . . . 0.0 110.013 -176.201 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.425 ' N ' ' SD ' ' A' ' 47' ' ' MET . 1.1 mpt? -50.84 -59.35 4.21 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.635 1.174 . . . . 0.0 112.194 -170.444 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -133.3 175.46 9.38 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 123.943 0.897 . . . . 0.0 109.393 178.21 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -138.12 148.93 45.45 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 124.551 1.14 . . . . 0.0 108.689 -178.98 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.3 pm0 -108.18 87.57 2.53 Favored 'General case' 0 N--CA 1.486 1.351 0 CA-C-O 122.009 0.909 . . . . 0.0 110.347 -174.844 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.48 HG22 ' HB2' ' A' ' 29' ' ' ALA . 15.6 m -95.56 166.52 1.81 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.734 0 O-C-N 121.525 -0.734 . . . . 0.0 109.614 179.955 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 15.2 ptpt -142.9 149.28 38.26 Favored 'General case' 0 C--N 1.351 0.669 0 CA-C-O 122.025 0.917 . . . . 0.0 113.437 -173.44 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.42 HD12 HD23 ' A' ' 25' ' ' LEU . 50.5 mt -119.2 158.9 25.06 Favored 'General case' 0 CA--C 1.543 0.678 0 C-N-CA 126.522 1.929 . . . . 0.0 107.588 178.68 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 39.1 p -122.31 129.05 51.78 Favored 'General case' 0 N--CA 1.482 1.167 0 CA-C-N 118.43 0.559 . . . . 0.0 110.622 175.049 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.9 m-85 -130.63 148.53 52.43 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 125.258 1.423 . . . . 0.0 108.936 -179.538 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.9 mt-10 -71.09 -22.36 62.11 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 122.771 0.428 . . . . 0.0 111.579 -177.675 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 41.3 p -132.47 157.21 45.2 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.217 0.607 . . . . 0.0 111.169 178.17 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.2 tt0 -58.82 -43.85 90.71 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 114.457 -1.247 . . . . 0.0 111.276 170.631 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.2 mp0 -59.05 -35.54 73.52 Favored 'General case' 0 N--CA 1.475 0.776 0 O-C-N 124.687 1.242 . . . . 0.0 111.494 -175.047 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 26.7 mt-30 -74.03 -30.02 62.21 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.076 0.551 . . . . 0.0 112.04 177.224 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -80.33 -37.83 31.79 Favored 'General case' 0 N--CA 1.484 1.24 0 CA-C-O 121.366 0.603 . . . . 0.0 110.903 -176.784 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -71.92 -37.71 70.0 Favored 'General case' 0 N--CA 1.469 0.493 0 CA-C-N 114.78 -1.1 . . . . 0.0 110.368 175.408 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -57.72 -35.39 70.61 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 123.645 0.778 . . . . 0.0 112.171 178.07 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 58.2 t80 -61.3 -60.3 3.94 Favored 'General case' 0 C--N 1.354 0.763 0 N-CA-C 109.169 -0.678 . . . . 0.0 109.169 175.073 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . 0.407 ' HB1' ' O ' ' A' ' 70' ' ' ILE . . . -51.99 -47.69 64.76 Favored 'General case' 0 CA--C 1.548 0.883 0 C-N-CA 124.973 1.309 . . . . 0.0 112.046 -177.761 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -60.81 -46.47 90.41 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.369 1.068 . . . . 0.0 111.341 179.999 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.7 ttt85 -63.36 -31.81 73.06 Favored 'General case' 0 N--CA 1.477 0.882 0 C-N-CA 124.588 1.155 . . . . 0.0 111.396 179.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.6 mmtt -89.21 -14.81 35.14 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.177 0.591 . . . . 0.0 111.462 -179.953 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.04 -3.4 76.93 Favored Glycine 0 C--N 1.35 1.348 0 C-N-CA 122.823 0.249 . . . . 0.0 112.789 -176.336 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.407 ' O ' ' HB1' ' A' ' 65' ' ' ALA . 59.3 mt -69.29 106.46 1.31 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.948 0 N-CA-C 109.334 -0.617 . . . . 0.0 109.334 179.122 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.8 pm0 -55.1 143.88 25.65 Favored 'General case' 0 N--CA 1.486 1.369 0 CA-C-N 114.268 -1.333 . . . . 0.0 109.397 170.528 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 48.3 p90 -135.8 146.84 47.97 Favored 'General case' 0 N--CA 1.472 0.638 0 CA-C-N 118.61 0.641 . . . . 0.0 112.116 -170.836 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.4 OUTLIER -114.36 125.36 53.78 Favored 'General case' 0 CA--C 1.54 0.588 0 N-CA-C 107.227 -1.398 . . . . 0.0 107.227 171.249 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 90.9 t -90.45 126.73 43.24 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 CA-C-O 121.12 0.486 . . . . 0.0 110.16 175.393 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.483 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.5 mp -105.93 112.39 39.04 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.6 0 N-CA-C 106.732 -1.581 . . . . 0.0 106.732 170.381 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 72.0 mt -59.67 153.64 50.76 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 123.633 0.773 . . . . 0.0 111.665 179.756 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.599 ' HB2' ' HG2' ' A' ' 79' ' ' GLU . 47.2 Cg_endo -64.16 169.09 11.23 Favored 'Trans proline' 0 C--N 1.372 1.794 0 C-N-CA 122.702 2.268 . . . . 0.0 112.839 -176.799 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -78.21 30.44 0.18 Allowed 'General case' 0 N--CA 1.491 1.603 0 C-N-CA 124.411 1.084 . . . . 0.0 112.214 178.906 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.599 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 9.3 pt-20 -159.23 6.21 0.1 Allowed 'General case' 0 CA--C 1.55 0.946 0 C-N-CA 125.164 1.386 . . . . 0.0 110.391 -169.939 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.064 0 C-N-CA 123.587 0.755 . . . . 0.0 111.601 -175.149 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.538 ' SD ' ' HB3' ' A' ' 30' ' ' GLU . 52.4 ttp . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 109.608 -0.515 . . . . 0.0 109.608 . . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 30.8 p -130.59 119.26 22.23 Favored 'General case' 0 N--CA 1.474 0.76 0 N-CA-C 108.129 -1.063 . . . . 0.0 108.129 177.258 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.433 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.49 134.59 44.35 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 122.87 0.468 . . . . 0.0 110.908 -167.629 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.56 122.82 48.28 Favored 'General case' 0 C--N 1.326 -0.451 0 N-CA-C 107.53 -1.285 . . . . 0.0 107.53 176.882 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.513 ' HB ' HG12 ' A' ' 74' ' ' VAL . 5.1 mp -107.21 122.57 61.54 Favored 'Isoleucine or valine' 0 N--CA 1.466 0.353 0 N-CA-C 106.98 -1.489 . . . . 0.0 106.98 178.84 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 38.4 p90 -147.78 172.99 13.24 Favored 'General case' 0 C--N 1.32 -0.685 0 N-CA-C 108.218 -1.03 . . . . 0.0 108.218 -175.46 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.484 ' O ' ' HB3' ' A' ' 77' ' ' PRO . 27.5 ttp180 -116.48 119.99 35.31 Favored Pre-proline 0 C--N 1.322 -0.601 0 N-CA-C 106.965 -1.494 . . . . 0.0 106.965 170.086 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.503 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 29.6 Cg_endo -59.59 97.38 0.1 Allowed 'Trans proline' 0 CA--C 1.55 1.319 0 C-N-CA 122.451 2.101 . . . . 0.0 111.814 177.807 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.51 -8.82 40.35 Favored 'General case' 0 CA--C 1.544 0.716 0 CA-C-N 114.658 -1.155 . . . . 0.0 109.493 165.233 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -103.25 30.81 4.65 Favored 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.882 1.273 . . . . 0.0 109.833 170.042 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 m -45.45 132.47 7.99 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 125.423 1.489 . . . . 0.0 113.418 -163.021 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.99 143.81 30.9 Favored 'General case' 0 CA--C 1.541 0.613 0 O-C-N 124.335 1.022 . . . . 0.0 110.608 176.063 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 83.8 mtp -59.5 113.91 2.44 Favored 'General case' 0 N--CA 1.474 0.754 0 O-C-N 123.951 0.782 . . . . 0.0 110.929 -174.072 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 28.8 mm-40 -68.04 82.71 0.22 Allowed 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 124.124 0.97 . . . . 0.0 110.165 -179.353 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 32.4 t -85.96 -69.64 0.65 Allowed 'General case' 0 C--O 1.24 0.597 0 C-N-CA 123.531 0.732 . . . . 0.0 109.829 -176.818 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -100.79 25.63 27.61 Favored Glycine 0 C--N 1.346 1.128 0 CA-C-N 116.297 -0.411 . . . . 0.0 112.245 178.419 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.401 ' OG1' ' HG2' ' A' ' 19' ' ' LYS . 9.8 t -151.62 171.08 18.19 Favored 'General case' 0 CA--C 1.541 0.628 0 C-N-CA 123.864 0.866 . . . . 0.0 109.569 -179.17 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -155.9 32.1 0.35 Allowed 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.135 0.974 . . . . 0.0 109.279 177.284 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.401 ' HG2' ' OG1' ' A' ' 17' ' ' THR . 14.5 mmmm -68.12 141.59 56.04 Favored 'General case' 0 N--CA 1.476 0.838 0 CA-C-N 115.885 -0.598 . . . . 0.0 111.348 -177.201 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 46.0 p -67.6 153.96 42.52 Favored 'General case' 0 C--O 1.244 0.772 0 O-C-N 124.093 0.871 . . . . 0.0 110.473 177.223 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 2.2 m120 -75.68 98.5 4.09 Favored 'General case' 0 N--CA 1.47 0.532 0 CA-C-O 121.828 0.823 . . . . 0.0 111.442 -169.98 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.503 ' O ' ' HD2' ' A' ' 8' ' ' PRO . 28.8 m -96.59 -174.69 0.33 Allowed 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 CA-C-N 114.296 -1.32 . . . . 0.0 109.172 175.232 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 49.7 m95 -93.11 132.75 36.96 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.39 0.676 . . . . 0.0 109.319 -179.683 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.487 HG22 HG22 ' A' ' 54' ' ' THR . 70.3 t -102.54 138.66 25.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.69 0 N-CA-C 109.669 -0.493 . . . . 0.0 109.669 177.715 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 5.7 tt -112.99 108.26 17.1 Favored 'General case' 0 CA--C 1.53 0.202 0 N-CA-C 105.499 -2.037 . . . . 0.0 105.499 176.21 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -119.94 131.15 55.11 Favored 'General case' 0 N--CA 1.47 0.548 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 -178.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.602 ' HE2' ' HG3' ' A' ' 30' ' ' GLU . 35.0 p90 -144.74 158.4 43.8 Favored 'General case' 0 N--CA 1.472 0.64 0 C-N-CA 123.522 0.729 . . . . 0.0 111.058 -178.628 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 9.9 p-10 -72.23 122.27 20.79 Favored 'General case' 0 N--CA 1.474 0.763 0 N-CA-C 106.835 -1.542 . . . . 0.0 106.835 168.405 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.483 ' HB3' ' HB3' ' A' ' 48' ' ' LYS . . . -59.19 152.51 20.4 Favored 'General case' 0 N--CA 1.476 0.856 0 N-CA-C 113.965 1.098 . . . . 0.0 113.965 -160.837 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.602 ' HG3' ' HE2' ' A' ' 27' ' ' PHE . 0.0 OUTLIER -100.84 14.11 32.8 Favored 'General case' 0 N--CA 1.473 0.7 0 CA-C-N 114.542 -1.208 . . . . 0.0 110.501 175.272 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -65.39 118.26 48.64 Favored Pre-proline 0 CA--C 1.556 1.184 0 N-CA-C 108.444 -0.947 . . . . 0.0 108.444 176.783 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 96.1 Cg_endo -76.79 -164.74 0.28 Allowed 'Trans proline' 0 C--N 1.365 1.443 0 C-N-CA 122.555 2.17 . . . . 0.0 112.96 -172.491 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 7.1 ptm180 -58.0 -28.94 64.87 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-N 115.48 -0.782 . . . . 0.0 110.848 169.013 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.3 tptm -76.83 79.99 3.42 Favored 'General case' 0 CA--C 1.544 0.749 0 C-N-CA 124.215 1.006 . . . . 0.0 109.611 179.831 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 64.9 mt -98.89 140.03 19.39 Favored 'Isoleucine or valine' 0 C--O 1.244 0.799 0 N-CA-C 107.71 -1.219 . . . . 0.0 107.71 170.136 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 7.1 m-20 -56.54 124.52 62.8 Favored Pre-proline 0 CA--C 1.542 0.649 0 C-N-CA 124.218 1.007 . . . . 0.0 111.537 -175.956 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 17.9 Cg_endo -58.1 -19.37 40.9 Favored 'Trans proline' 0 C--N 1.377 2.048 0 C-N-CA 123.353 2.702 . . . . 0.0 112.777 175.271 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 36.4 mm -58.68 -48.47 85.76 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.917 0 C-N-CA 124.476 1.111 . . . . 0.0 110.312 173.1 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 63.0 mtt -77.5 -37.26 51.54 Favored 'General case' 0 N--CA 1.484 1.251 0 C-N-CA 123.247 0.619 . . . . 0.0 110.349 174.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 160.62 124.99 0.75 Allowed Glycine 0 C--N 1.337 0.601 0 N-CA-C 110.386 -1.085 . . . . 0.0 110.386 -178.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 69.0 t80 -74.4 90.67 2.18 Favored 'General case' 0 N--CA 1.473 0.691 0 N-CA-C 109.105 -0.702 . . . . 0.0 109.105 179.02 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 82.4 p -87.58 140.06 29.91 Favored 'General case' 0 C--O 1.239 0.515 0 CA-C-N 115.643 -0.708 . . . . 0.0 111.967 -173.867 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 41.9 m -73.86 -33.35 64.06 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.647 -0.706 . . . . 0.0 109.16 162.92 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 30.5 t 67.09 82.14 0.19 Allowed 'General case' 0 C--N 1.354 0.789 0 C-N-CA 125.411 1.484 . . . . 0.0 111.461 -179.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 32.0 t -97.26 -14.81 21.13 Favored 'General case' 0 N--CA 1.479 0.985 0 CA-C-N 114.999 -1.001 . . . . 0.0 109.609 170.172 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -100.37 167.25 10.52 Favored 'General case' 0 C--O 1.243 0.748 0 C-N-CA 124.292 1.037 . . . . 0.0 110.773 -175.25 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.7 OUTLIER -88.37 175.97 7.4 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 123.483 0.713 . . . . 0.0 111.588 -179.449 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.483 ' HB3' ' HB3' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -93.06 130.36 38.69 Favored 'General case' 0 CA--C 1.536 0.442 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.189 -169.957 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.6 pt20 -69.13 173.68 5.35 Favored 'General case' 0 N--CA 1.48 1.038 0 C-N-CA 123.906 0.882 . . . . 0.0 110.736 177.537 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -81.67 152.92 26.88 Favored 'General case' 0 N--CA 1.473 0.715 0 CA-C-O 121.575 0.702 . . . . 0.0 111.024 179.649 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 15.8 m -140.17 147.53 23.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.877 0 CA-C-N 114.327 -1.306 . . . . 0.0 109.435 -179.17 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -139.5 136.03 34.12 Favored 'General case' 0 CA--C 1.544 0.733 0 CA-C-O 121.676 0.75 . . . . 0.0 111.363 -175.444 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.5 mp -123.81 153.91 40.33 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 125.591 1.556 . . . . 0.0 107.448 -178.999 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.487 HG22 HG22 ' A' ' 24' ' ' VAL . 17.1 p -120.54 125.18 47.17 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-N 119.381 0.991 . . . . 0.0 111.154 -179.548 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 84.3 m-85 -124.44 145.49 49.47 Favored 'General case' 0 N--CA 1.468 0.457 0 C-N-CA 125.905 1.682 . . . . 0.0 107.448 178.516 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.463 ' HB2' HE22 ' A' ' 60' ' ' GLN . 45.8 mt-10 -69.99 -22.63 63.12 Favored 'General case' 0 N--CA 1.482 1.141 0 N-CA-C 112.461 0.541 . . . . 0.0 112.461 -172.933 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 45.1 p -135.72 162.38 32.93 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.414 0.686 . . . . 0.0 110.146 178.6 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 26.2 tt0 -61.64 -40.93 96.66 Favored 'General case' 0 N--CA 1.473 0.718 0 CA-C-N 115.565 -0.743 . . . . 0.0 110.57 173.833 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 6.1 mp0 -59.49 -39.54 84.09 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.713 0.805 . . . . 0.0 111.585 -175.007 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.463 HE22 ' HB2' ' A' ' 56' ' ' GLU . 49.1 mt-30 -67.7 -33.21 74.45 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 122.936 0.495 . . . . 0.0 111.337 178.926 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.03 -39.68 25.43 Favored 'General case' 0 N--CA 1.473 0.682 0 CA-C-O 121.148 0.499 . . . . 0.0 111.046 -176.494 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.5 pt-20 -74.38 -39.0 63.0 Favored 'General case' 0 N--CA 1.471 0.578 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.305 -178.161 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -66.29 -32.34 73.69 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.485 0.714 . . . . 0.0 111.76 176.024 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 86.9 t80 -66.69 -49.25 66.7 Favored 'General case' 0 N--CA 1.474 0.756 0 N-CA-C 109.601 -0.518 . . . . 0.0 109.601 177.335 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -57.21 -45.16 84.07 Favored 'General case' 0 CA--C 1.546 0.794 0 C-N-CA 124.094 0.958 . . . . 0.0 111.187 174.605 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.5 mt-30 -62.64 -42.96 99.89 Favored 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 123.957 0.903 . . . . 0.0 111.324 179.507 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 30.5 ttm180 -55.48 -36.74 66.94 Favored 'General case' 0 N--CA 1.481 1.086 0 C-N-CA 124.965 1.306 . . . . 0.0 110.825 175.776 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 72.9 mmtt -87.09 -21.0 26.3 Favored 'General case' 0 CA--C 1.541 0.633 0 CA-C-N 115.041 -0.982 . . . . 0.0 110.882 -179.793 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.62 -10.68 66.74 Favored Glycine 0 C--N 1.35 1.313 0 CA-C-O 119.265 -0.742 . . . . 0.0 112.536 -174.503 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.45 HG12 ' SD ' ' A' ' 1' ' ' MET . 52.7 mt -52.63 114.3 0.45 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.818 0.847 . . . . 0.0 111.512 -173.224 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 1.9 pm0 -58.14 130.4 46.44 Favored 'General case' 0 N--CA 1.47 0.572 0 CA-C-N 113.861 -1.518 . . . . 0.0 108.739 170.274 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.7 p90 -142.16 146.64 35.53 Favored 'General case' 0 CA--C 1.533 0.324 0 CA-C-O 121.045 0.45 . . . . 0.0 111.509 -169.875 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 15.8 tpt180 -114.86 133.81 55.66 Favored 'General case' 0 CA--C 1.532 0.267 0 C-N-CA 124.683 1.193 . . . . 0.0 107.797 171.581 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.513 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.7 m -103.32 127.48 57.21 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.728 0 CA-C-O 121.389 0.614 . . . . 0.0 109.426 174.545 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -118.26 132.25 68.65 Favored 'Isoleucine or valine' 0 C--O 1.24 0.599 0 C-N-CA 125.432 1.493 . . . . 0.0 107.282 -177.461 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 34.4 mt -75.27 149.37 84.48 Favored Pre-proline 0 C--O 1.24 0.564 0 O-C-N 122.997 0.186 . . . . 0.0 110.573 173.84 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.6 ' HB2' ' HG2' ' A' ' 79' ' ' GLU . 48.7 Cg_endo -67.89 158.88 55.36 Favored 'Trans proline' 0 C--N 1.37 1.684 0 C-N-CA 122.063 1.842 . . . . 0.0 111.269 174.929 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.76 -27.18 69.11 Favored 'General case' 0 N--CA 1.486 1.368 0 C-N-CA 122.668 0.387 . . . . 0.0 110.677 -179.935 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.6 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 17.0 pt-20 -71.15 -28.27 64.15 Favored 'General case' 0 N--CA 1.475 0.804 0 C-N-CA 124.2 1.0 . . . . 0.0 111.27 -179.921 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.356 0.849 0 N-CA-C 108.745 -0.835 . . . . 0.0 108.745 176.707 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.564 ' SD ' ' NZ ' ' A' ' 48' ' ' LYS . 7.7 mmt . . . . . 0 N--CA 1.48 1.035 0 N-CA-C 108.633 -0.877 . . . . 0.0 108.633 . . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.413 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 50.4 m -125.66 117.23 23.06 Favored 'General case' 0 N--CA 1.473 0.68 0 N-CA-C 108.096 -1.076 . . . . 0.0 108.096 -179.99 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.11 136.41 41.0 Favored 'General case' 0 N--CA 1.473 0.716 0 C-N-CA 122.965 0.506 . . . . 0.0 109.716 -173.935 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.6 ptpp? -108.24 123.55 48.95 Favored 'General case' 0 CA--C 1.541 0.606 0 N-CA-C 107.963 -1.125 . . . . 0.0 107.963 176.424 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.481 HG12 HD13 ' A' ' 25' ' ' LEU . 59.3 mt -104.29 121.04 55.48 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.425 0 N-CA-C 107.408 -1.33 . . . . 0.0 107.408 178.225 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 12.3 p90 -146.59 176.63 9.68 Favored 'General case' 0 C--N 1.314 -0.938 0 N-CA-C 108.247 -1.02 . . . . 0.0 108.247 -178.519 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.694 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 60.3 ttt180 -136.41 94.62 13.55 Favored Pre-proline 0 C--N 1.318 -0.766 0 N-CA-C 107.78 -1.192 . . . . 0.0 107.78 178.075 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 11.3 Cg_endo -91.32 -158.5 0.07 OUTLIER 'Trans proline' 0 C--N 1.368 1.587 0 C-N-CA 123.483 2.789 . . . . 0.0 111.559 -172.981 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -122.52 12.81 10.08 Favored 'General case' 0 CA--C 1.544 0.736 0 N-CA-C 108.001 -1.111 . . . . 0.0 108.001 172.241 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.6 tppt? -80.51 -15.19 57.3 Favored 'General case' 0 C--N 1.349 0.558 0 C-N-CA 125.532 1.533 . . . . 0.0 111.142 -176.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 33.2 p -61.2 94.51 0.04 OUTLIER 'General case' 0 CA--C 1.552 1.031 0 C-N-CA 124.119 0.968 . . . . 0.0 110.452 174.997 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.76 -176.3 5.32 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 124.07 0.948 . . . . 0.0 110.521 177.85 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 57.7 mtm -67.09 87.23 0.15 Allowed 'General case' 0 N--CA 1.478 0.925 0 C-N-CA 122.916 0.487 . . . . 0.0 109.792 179.752 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 61.7 tt0 -92.65 109.24 20.65 Favored 'General case' 0 N--CA 1.465 0.293 0 N-CA-C 108.173 -1.047 . . . . 0.0 108.173 -179.726 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 9.4 t 61.88 23.74 14.01 Favored 'General case' 0 CA--C 1.558 1.258 0 C-N-CA 124.278 1.031 . . . . 0.0 110.316 -173.095 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 99.79 -41.33 2.2 Favored Glycine 0 C--N 1.353 1.522 0 CA-C-N 115.484 -0.78 . . . . 0.0 112.603 -177.746 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.0 t -77.43 135.08 38.26 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.284 0.634 . . . . 0.0 111.802 -172.085 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -169.32 11.81 0.02 OUTLIER 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 124.536 1.134 . . . . 0.0 111.409 -177.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.4 mttm -63.18 -33.45 75.49 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 123.358 0.663 . . . . 0.0 111.247 -176.51 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 63.1 p -113.04 130.87 56.0 Favored 'General case' 0 C--O 1.242 0.704 0 C-N-CA 124.06 0.944 . . . . 0.0 108.73 173.015 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -78.46 102.29 7.75 Favored 'General case' 0 N--CA 1.468 0.435 0 N-CA-C 108.605 -0.887 . . . . 0.0 108.605 172.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.8 m -79.71 -179.41 0.43 Allowed 'Isoleucine or valine' 0 N--CA 1.477 0.901 0 C-N-CA 123.316 0.647 . . . . 0.0 111.547 -177.13 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 64.4 m95 -84.88 129.54 34.79 Favored 'General case' 0 CA--C 1.539 0.536 0 N-CA-C 108.608 -0.886 . . . . 0.0 108.608 -177.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.9 t -102.74 138.49 26.83 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.553 0 CA-C-O 121.396 0.617 . . . . 0.0 109.739 175.988 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.481 HD13 HG12 ' A' ' 5' ' ' ILE . 60.4 tp -116.06 105.49 12.68 Favored 'General case' 0 N--CA 1.453 -0.295 0 N-CA-C 106.678 -1.601 . . . . 0.0 106.678 179.069 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 1.1 tm-20 -114.41 131.11 56.7 Favored 'General case' 0 C--N 1.32 -0.675 0 N-CA-C 107.95 -1.13 . . . . 0.0 107.95 -176.367 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 21.4 p90 -146.67 157.05 43.62 Favored 'General case' 0 C--O 1.235 0.317 0 C-N-CA 124.236 1.014 . . . . 0.0 110.713 178.21 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 10.3 p-10 -69.56 128.42 36.42 Favored 'General case' 0 CA--C 1.553 1.08 0 N-CA-C 106.126 -1.805 . . . . 0.0 106.126 164.459 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.409 ' HB2' ' O ' ' A' ' 49' ' ' GLN . . . -52.43 141.42 19.92 Favored 'General case' 0 N--CA 1.496 1.843 0 N-CA-C 114.034 1.124 . . . . 0.0 114.034 -164.933 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -80.5 48.02 1.0 Allowed 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.53 1.132 . . . . 0.0 110.522 177.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 12.5 p -114.13 130.53 23.84 Favored Pre-proline 0 CA--C 1.548 0.901 0 O-C-N 122.018 -0.426 . . . . 0.0 110.139 -172.741 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 72.6 Cg_endo -82.82 -148.52 0.04 OUTLIER 'Trans proline' 0 C--N 1.365 1.417 0 C-N-CA 122.49 2.126 . . . . 0.0 110.298 164.574 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 5.9 ppt_? -82.8 50.7 1.74 Allowed 'General case' 0 CA--C 1.558 1.276 0 CA-C-O 121.424 0.63 . . . . 0.0 110.242 167.986 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 22.6 tptm -80.95 72.85 7.98 Favored 'General case' 0 C--N 1.361 1.099 0 C-N-CA 123.992 0.917 . . . . 0.0 109.461 -175.782 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.633 HD12 ' HA ' ' A' ' 42' ' ' THR . 6.1 pt -144.81 145.15 21.36 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 124.904 1.282 . . . . 0.0 108.709 -173.145 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 2.9 m-20 -109.58 156.0 40.37 Favored Pre-proline 0 N--CA 1.481 1.092 0 C-N-CA 123.314 0.646 . . . . 0.0 110.904 -177.411 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 21.1 Cg_endo -59.5 -34.44 97.04 Favored 'Trans proline' 0 C--N 1.38 2.202 0 C-N-CA 122.57 2.18 . . . . 0.0 111.136 171.73 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 51.2 mt -61.22 -37.95 78.66 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.971 0 C-N-CA 124.102 0.961 . . . . 0.0 110.612 178.099 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 64.0 mtt -67.14 -35.37 79.57 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.498 0.719 . . . . 0.0 111.426 179.353 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 71.35 18.55 76.91 Favored Glycine 0 C--N 1.347 1.157 0 O-C-N 123.619 0.575 . . . . 0.0 112.922 -177.258 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 30.3 t80 -104.62 26.43 9.07 Favored 'General case' 0 CA--C 1.553 1.07 0 C-N-CA 123.873 0.869 . . . . 0.0 109.179 179.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.633 ' HA ' HD12 ' A' ' 35' ' ' ILE . 20.0 p -81.37 -30.33 33.76 Favored 'General case' 0 CA--C 1.545 0.759 0 C-N-CA 123.799 0.84 . . . . 0.0 112.453 -174.884 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 38.9 t -67.53 -44.71 77.7 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-O 121.263 0.554 . . . . 0.0 109.595 175.136 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 45.0 m -91.13 71.67 6.3 Favored 'General case' 0 CA--C 1.542 0.646 0 CA-C-N 115.404 -0.816 . . . . 0.0 109.474 175.545 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 22.9 t -70.55 94.21 0.97 Allowed 'General case' 0 CA--C 1.542 0.645 0 CA-C-N 115.433 -0.803 . . . . 0.0 109.397 178.016 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.4 t70 -71.15 121.69 18.79 Favored 'General case' 0 N--CA 1.472 0.632 0 CA-C-N 116.082 -0.508 . . . . 0.0 110.941 -174.147 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 54.7 mtt -88.05 -43.4 11.74 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 123.65 0.78 . . . . 0.0 110.677 -176.516 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.564 ' NZ ' ' SD ' ' A' ' 1' ' ' MET . 0.0 OUTLIER -172.49 86.46 0.07 Allowed 'General case' 0 N--CA 1.481 1.082 0 CA-C-O 121.601 0.715 . . . . 0.0 111.045 178.501 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.409 ' O ' ' HB2' ' A' ' 29' ' ' ALA . 25.5 pt20 -74.5 141.95 44.85 Favored 'General case' 0 N--CA 1.486 1.368 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 171.628 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 2.1 mp0 -70.6 133.59 46.85 Favored 'General case' 0 CA--C 1.54 0.562 0 O-C-N 121.627 -0.67 . . . . 0.0 109.751 -176.924 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 16.0 m -137.45 149.63 25.69 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.638 0 CA-C-N 114.68 -1.145 . . . . 0.0 109.087 -173.374 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.8 ptmm? -142.62 136.25 28.96 Favored 'General case' 0 N--CA 1.467 0.379 0 CA-C-O 121.631 0.729 . . . . 0.0 111.377 -179.183 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 7.4 mp -121.64 147.59 45.66 Favored 'General case' 0 CA--C 1.536 0.426 0 CA-C-N 113.866 -1.516 . . . . 0.0 107.2 -178.295 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.4 p -113.16 132.55 55.43 Favored 'General case' 0 N--CA 1.474 0.758 0 C-N-CA 123.261 0.624 . . . . 0.0 110.186 -178.751 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.489 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.7 m-85 -132.85 148.24 52.3 Favored 'General case' 0 N--CA 1.47 0.534 0 C-N-CA 125.298 1.439 . . . . 0.0 108.509 -179.679 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.411 ' HB2' HE22 ' A' ' 60' ' ' GLN . 44.0 mt-10 -70.15 -26.75 64.08 Favored 'General case' 0 N--CA 1.485 1.284 0 O-C-N 123.283 0.364 . . . . 0.0 111.915 -177.72 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 58.6 p -133.17 163.27 29.66 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.05 0.54 . . . . 0.0 110.096 178.297 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 7.3 tt0 -62.13 -39.1 91.42 Favored 'General case' 0 N--CA 1.472 0.661 0 CA-C-N 114.959 -1.018 . . . . 0.0 110.828 171.263 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 36.4 mt-10 -53.06 -43.16 66.47 Favored 'General case' 0 N--CA 1.477 0.911 0 C-N-CA 124.473 1.109 . . . . 0.0 111.469 -178.452 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.489 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 64.3 mt-30 -67.74 -36.25 80.21 Favored 'General case' 0 CA--C 1.552 1.033 0 C-N-CA 124.064 0.945 . . . . 0.0 111.395 179.625 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.03 -39.7 55.1 Favored 'General case' 0 N--CA 1.483 1.224 0 C-N-CA 122.973 0.509 . . . . 0.0 111.127 -175.768 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.6 pt-20 -70.85 -37.48 73.12 Favored 'General case' 0 N--CA 1.47 0.537 0 CA-C-N 115.389 -0.823 . . . . 0.0 110.562 177.007 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.37 -38.72 69.21 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.523 0.729 . . . . 0.0 111.925 174.887 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 76.5 t80 -63.39 -60.62 3.14 Favored 'General case' 0 C--N 1.351 0.64 0 C-N-CA 123.325 0.65 . . . . 0.0 110.005 177.253 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.41 -47.41 66.3 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.489 1.115 . . . . 0.0 112.293 -178.967 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.4 mt-30 -61.9 -45.8 92.17 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 124.006 0.922 . . . . 0.0 111.452 -179.891 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 74.5 ttt180 -59.72 -34.37 72.84 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.081 0.952 . . . . 0.0 110.936 177.934 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 35.0 mmtp -86.87 -20.56 27.26 Favored 'General case' 0 N--CA 1.479 1.014 0 C-N-CA 123.333 0.653 . . . . 0.0 111.407 -179.275 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.18 2.05 74.73 Favored Glycine 0 CA--C 1.534 1.264 0 CA-C-N 116.643 -0.253 . . . . 0.0 112.786 -173.842 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 62.7 mt -62.97 110.52 0.77 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 C-N-CA 122.568 0.347 . . . . 0.0 110.179 178.303 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.413 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.6 pt-20 -58.58 136.93 57.71 Favored 'General case' 0 N--CA 1.482 1.145 0 O-C-N 124.95 1.407 . . . . 0.0 108.407 170.494 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -144.42 151.52 39.36 Favored 'General case' 0 N--CA 1.472 0.665 0 CA-C-N 118.357 0.526 . . . . 0.0 110.997 -171.906 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.459 ' NH1' HG13 ' A' ' 75' ' ' ILE . 3.5 tmt_? -125.44 140.34 52.86 Favored 'General case' 0 N--CA 1.47 0.553 0 C-N-CA 124.516 1.127 . . . . 0.0 108.26 171.4 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 57.4 t -105.57 136.84 38.04 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 123.352 0.661 . . . . 0.0 111.032 -178.077 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.459 HG13 ' NH1' ' A' ' 73' ' ' ARG . 2.3 mp -111.26 150.47 13.65 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.955 0 C-N-CA 125.933 1.693 . . . . 0.0 107.791 174.425 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 79.4 mt -74.67 154.87 87.38 Favored Pre-proline 0 CA--C 1.556 1.205 0 C-N-CA 122.841 0.457 . . . . 0.0 110.987 173.959 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.694 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 40.8 Cg_endo -64.35 169.47 10.92 Favored 'Trans proline' 0 C--N 1.379 2.169 0 C-N-CA 123.317 2.678 . . . . 0.0 114.336 -177.404 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.405 ' HD2' ' N ' ' A' ' 79' ' ' GLU . 0.0 OUTLIER -66.53 -19.96 65.91 Favored 'General case' 0 N--CA 1.488 1.427 0 C-N-CA 123.729 0.812 . . . . 0.0 111.438 172.061 . . . . . . . . 3 3 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.568 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 11.4 pt-20 -96.96 10.95 37.7 Favored 'General case' 0 CA--C 1.547 0.843 0 C-N-CA 124.24 1.016 . . . . 0.0 111.15 179.946 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 C--N 1.354 0.771 0 C-N-CA 122.963 0.505 . . . . 0.0 110.632 -178.979 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.7 mmt . . . . . 0 N--CA 1.484 1.251 0 N-CA-C 109.524 -0.547 . . . . 0.0 109.524 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 26.9 m -116.77 133.71 55.69 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.035 0.534 . . . . 0.0 111.197 -172.291 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -102.31 144.39 30.86 Favored 'General case' 0 N--CA 1.47 0.536 0 N-CA-C 108.79 -0.819 . . . . 0.0 108.79 174.883 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -107.71 124.92 50.73 Favored 'General case' 0 CA--C 1.545 0.773 0 N-CA-C 108.266 -1.013 . . . . 0.0 108.266 176.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.62 HG21 ' HG2' ' A' ' 58' ' ' GLN . 70.3 mt -103.28 123.71 56.96 Favored 'Isoleucine or valine' 0 CA--C 1.517 -0.315 0 N-CA-C 107.052 -1.462 . . . . 0.0 107.052 172.073 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 11.6 p90 -148.46 176.22 10.49 Favored 'General case' 0 C--N 1.312 -1.037 0 N-CA-C 108.091 -1.077 . . . . 0.0 108.091 177.347 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.584 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 60.2 ttt180 -141.68 97.52 6.59 Favored Pre-proline 0 C--N 1.32 -0.692 0 N-CA-C 107.066 -1.457 . . . . 0.0 107.066 174.099 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 65.2 Cg_endo -73.13 157.72 50.18 Favored 'Trans proline' 0 C--N 1.36 1.136 0 C-N-CA 121.715 1.61 . . . . 0.0 111.714 -176.108 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -57.85 -31.41 66.64 Favored 'General case' 0 N--CA 1.476 0.867 0 CA-C-N 115.794 -0.639 . . . . 0.0 110.48 173.758 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.9 ptmt -136.08 116.18 13.38 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.536 1.134 . . . . 0.0 109.063 173.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 30.2 p -74.72 -24.21 58.7 Favored 'General case' 0 N--CA 1.477 0.888 0 C-N-CA 123.392 0.677 . . . . 0.0 110.642 175.983 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -162.44 -160.37 0.65 Allowed 'General case' 0 CA--C 1.541 0.627 0 C-N-CA 124.983 1.313 . . . . 0.0 107.521 176.424 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 62.8 mtt -67.4 110.67 3.68 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 108.629 -0.878 . . . . 0.0 108.629 171.341 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 29.3 mm-40 -117.25 59.87 0.76 Allowed 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 123.68 0.792 . . . . 0.0 111.411 -171.784 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.6 p -144.27 114.8 7.63 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.029 0.532 . . . . 0.0 110.072 175.661 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 79.75 23.6 61.82 Favored Glycine 0 C--N 1.348 1.231 0 CA-C-N 116.154 -0.475 . . . . 0.0 112.493 -177.294 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 13.0 t -142.32 177.19 8.43 Favored 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 123.669 0.787 . . . . 0.0 110.062 -176.066 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -61.85 132.54 53.4 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 123.416 0.687 . . . . 0.0 111.266 176.839 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.484 ' HA ' ' HE2' ' A' ' 19' ' ' LYS . 9.6 mmpt? -74.79 87.46 2.24 Favored 'General case' 0 C--N 1.347 0.461 0 N-CA-C 108.793 -0.817 . . . . 0.0 108.793 176.364 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 13.2 t -101.5 31.28 3.83 Favored 'General case' 0 CA--C 1.545 0.771 0 CA-C-N 114.904 -1.044 . . . . 0.0 109.536 -179.846 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 12.9 m120 -71.53 76.6 0.79 Allowed 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 124.267 1.027 . . . . 0.0 110.076 178.597 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 26.7 m -119.73 -170.58 0.56 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.768 0 C-N-CA 125.022 1.329 . . . . 0.0 109.8 -176.295 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 67.2 m95 -85.17 132.17 34.33 Favored 'General case' 0 C--O 1.235 0.29 0 N-CA-C 108.535 -0.913 . . . . 0.0 108.535 -175.599 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 95.6 t -101.06 139.13 23.09 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.529 0 CA-C-N 115.52 -0.764 . . . . 0.0 109.13 177.435 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.516 HD23 HG12 ' A' ' 5' ' ' ILE . 3.4 tm? -116.84 104.6 11.49 Favored 'General case' 0 CA--C 1.519 -0.224 0 N-CA-C 105.026 -2.213 . . . . 0.0 105.026 174.129 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -107.81 137.48 45.75 Favored 'General case' 0 C--O 1.212 -0.897 0 N-CA-C 107.017 -1.475 . . . . 0.0 107.017 175.879 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.4 p90 -124.44 159.75 29.77 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 123.174 0.59 . . . . 0.0 109.9 -178.887 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.513 ' HA ' ' HG3' ' A' ' 50' ' ' GLN . 29.0 t70 -97.98 93.65 6.43 Favored 'General case' 0 C--O 1.24 0.556 0 N-CA-C 105.823 -1.917 . . . . 0.0 105.823 -177.917 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.529 ' HB1' HG12 ' A' ' 31' ' ' VAL . . . -59.46 134.95 57.48 Favored 'General case' 0 N--CA 1.467 0.424 0 CA-C-N 115.955 -0.566 . . . . 0.0 110.197 178.872 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -91.21 31.26 1.14 Allowed 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.634 0.774 . . . . 0.0 110.758 -178.22 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.529 HG12 ' HB1' ' A' ' 29' ' ' ALA . 9.2 p -133.77 112.41 12.59 Favored Pre-proline 0 CA--C 1.56 1.361 0 C-N-CA 122.915 0.486 . . . . 0.0 110.2 -169.81 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.683 ' HA ' ' H ' ' A' ' 48' ' ' LYS . 77.4 Cg_endo -78.69 -154.82 0.05 OUTLIER 'Trans proline' 0 C--N 1.378 2.086 0 C-N-CA 123.306 2.67 . . . . 0.0 112.143 178.729 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.532 ' HG3' ' HD3' ' A' ' 34' ' ' LYS . 28.7 ptt180 -44.8 -29.62 0.82 Allowed 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.903 1.281 . . . . 0.0 114.158 178.081 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . 0.532 ' HD3' ' HG3' ' A' ' 33' ' ' ARG . 0.0 OUTLIER -73.82 82.75 1.64 Allowed 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 122.643 0.377 . . . . 0.0 110.348 178.091 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.41 HD12 ' HB3' ' A' ' 44' ' ' SER . 80.9 mt -129.27 158.97 41.79 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.258 0 C-N-CA 125.247 1.419 . . . . 0.0 108.342 177.762 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.3 m-20 -41.01 131.72 1.91 Allowed Pre-proline 0 N--CA 1.489 1.496 0 C-N-CA 124.964 1.306 . . . . 0.0 112.097 176.262 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.5 Cg_endo -57.86 -19.1 37.7 Favored 'Trans proline' 0 C--N 1.378 2.13 0 C-N-CA 123.335 2.69 . . . . 0.0 113.364 -176.335 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 45.0 mm -64.17 -39.46 85.57 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.919 0 C-N-CA 124.511 1.124 . . . . 0.0 111.106 176.996 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 25.1 ptt? -137.94 23.74 2.83 Favored 'General case' 0 N--CA 1.482 1.132 0 C-N-CA 123.666 0.787 . . . . 0.0 111.055 -173.331 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -120.06 -52.51 0.26 Allowed Glycine 0 N--CA 1.47 0.953 0 CA-C-O 120.059 -0.301 . . . . 0.0 113.566 -171.103 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -58.98 100.85 0.08 Allowed 'General case' 0 N--CA 1.479 0.976 0 C-N-CA 123.482 0.713 . . . . 0.0 110.913 -177.308 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.733 ' HA ' ' HB2' ' A' ' 45' ' ' SER . 81.9 p 68.22 -22.23 0.13 Allowed 'General case' 0 N--CA 1.487 1.377 0 C-N-CA 126.86 2.064 . . . . 0.0 114.366 174.89 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.8 t -73.4 -19.91 60.87 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.82 0.848 . . . . 0.0 110.061 170.691 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.41 ' HB3' HD12 ' A' ' 35' ' ' ILE . 51.4 m -136.52 56.04 1.82 Allowed 'General case' 0 CA--C 1.541 0.607 0 C-N-CA 124.479 1.112 . . . . 0.0 108.705 174.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.733 ' HB2' ' HA ' ' A' ' 42' ' ' THR . 23.1 t -87.64 35.03 0.71 Allowed 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.895 0.878 . . . . 0.0 110.683 -179.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 5.2 m-20 -132.72 166.43 22.23 Favored 'General case' 0 N--CA 1.481 1.122 0 C-N-CA 124.028 0.931 . . . . 0.0 110.074 -175.989 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.2 pmm? -83.77 111.15 18.92 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.521 -0.763 . . . . 0.0 109.383 175.085 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.683 ' H ' ' HA ' ' A' ' 32' ' ' PRO . 84.5 mttt 70.43 110.34 0.06 Allowed 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 124.936 1.294 . . . . 0.0 111.791 170.115 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 8.9 pt20 -89.48 101.95 14.63 Favored 'General case' 0 N--CA 1.476 0.855 0 CA-C-O 121.043 0.449 . . . . 0.0 110.53 -179.87 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.513 ' HG3' ' HA ' ' A' ' 28' ' ' ASP . 26.7 mp0 -76.37 88.38 3.16 Favored 'General case' 0 N--CA 1.477 0.903 0 N-CA-C 108.878 -0.786 . . . . 0.0 108.878 177.391 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 25.4 t -86.88 164.2 2.4 Favored 'Isoleucine or valine' 0 C--O 1.24 0.568 0 C-N-CA 124.551 1.14 . . . . 0.0 108.498 -174.768 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.3 ptpp? -137.44 146.54 44.47 Favored 'General case' 0 CA--C 1.531 0.248 0 CA-C-O 121.772 0.796 . . . . 0.0 111.628 -173.723 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.4 mp -119.61 157.27 28.77 Favored 'General case' 0 N--CA 1.464 0.228 0 CA-C-N 113.653 -1.612 . . . . 0.0 106.978 175.387 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 48.5 p -121.73 131.6 54.17 Favored 'General case' 0 CA--C 1.534 0.357 0 CA-C-O 120.992 0.425 . . . . 0.0 110.193 175.399 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.5 m-85 -128.17 147.49 50.56 Favored 'General case' 0 N--CA 1.467 0.388 0 C-N-CA 125.503 1.521 . . . . 0.0 107.982 178.587 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 50.0 mt-10 -69.05 -24.21 64.15 Favored 'General case' 0 N--CA 1.481 1.121 0 C-N-CA 122.656 0.382 . . . . 0.0 111.84 -176.736 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 79.8 p -132.99 160.5 36.96 Favored 'General case' 0 C--O 1.243 0.758 0 C-N-CA 123.927 0.891 . . . . 0.0 110.193 179.267 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.62 ' HG2' HG21 ' A' ' 5' ' ' ILE . 1.0 OUTLIER -60.88 -40.41 92.91 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.078 0.951 . . . . 0.0 110.317 170.803 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 12.5 mp0 -57.3 -39.7 76.32 Favored 'General case' 0 CA--C 1.539 0.538 0 C-N-CA 124.75 1.22 . . . . 0.0 111.754 -174.573 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 22.2 mt-30 -70.93 -30.78 67.19 Favored 'General case' 0 CA--C 1.55 0.957 0 C-N-CA 122.963 0.505 . . . . 0.0 112.013 177.404 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -76.2 -40.08 53.11 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 123.202 0.601 . . . . 0.0 111.14 -177.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -72.9 -37.59 67.2 Favored 'General case' 0 N--CA 1.471 0.591 0 CA-C-N 115.175 -0.92 . . . . 0.0 110.951 177.724 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.84 -37.78 77.24 Favored 'General case' 0 N--CA 1.474 0.743 0 C-N-CA 123.244 0.618 . . . . 0.0 111.98 173.342 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 90.0 t80 -65.61 -59.33 4.06 Favored 'General case' 0 CA--C 1.542 0.645 0 C-N-CA 123.532 0.733 . . . . 0.0 110.384 176.904 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.28 -49.52 69.42 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.544 1.138 . . . . 0.0 112.583 -177.949 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.6 mt-30 -64.18 -37.84 88.9 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.402 0.681 . . . . 0.0 111.73 -178.255 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 42.2 ttm180 -62.17 -30.96 71.42 Favored 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 123.929 0.892 . . . . 0.0 110.692 175.891 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.9 mmtp -85.92 -21.93 27.7 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.496 0.718 . . . . 0.0 110.629 177.052 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.6 -1.75 62.08 Favored Glycine 0 C--N 1.35 1.354 0 O-C-N 123.321 0.388 . . . . 0.0 112.722 -174.616 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 26.8 mt -68.11 109.34 1.66 Allowed 'Isoleucine or valine' 0 CA--C 1.553 1.076 0 CA-C-O 121.601 0.715 . . . . 0.0 110.144 -178.703 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.7 pt-20 -58.08 141.34 50.38 Favored 'General case' 0 N--CA 1.484 1.268 0 CA-C-N 113.539 -1.664 . . . . 0.0 108.772 169.02 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -141.12 149.86 42.11 Favored 'General case' 0 N--CA 1.474 0.747 0 CA-C-N 118.146 0.43 . . . . 0.0 111.391 -169.63 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 16.8 tpp180 -120.97 127.65 52.0 Favored 'General case' 0 N--CA 1.471 0.592 0 C-N-CA 123.747 0.819 . . . . 0.0 109.494 172.955 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.402 HG22 HD12 ' A' ' 5' ' ' ILE . 35.1 t -102.51 134.83 42.25 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.701 0 C-N-CA 123.761 0.825 . . . . 0.0 108.872 -176.121 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 60.9 mt -130.71 121.04 49.42 Favored 'Isoleucine or valine' 0 C--O 1.241 0.626 0 N-CA-C 107.778 -1.193 . . . . 0.0 107.778 -178.704 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 75.1 mt -63.8 143.58 98.07 Favored Pre-proline 0 CA--C 1.544 0.713 0 C-N-CA 123.744 0.817 . . . . 0.0 112.032 -175.217 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.584 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 47.0 Cg_endo -71.24 -176.28 1.84 Allowed 'Trans proline' 0 C--N 1.369 1.654 0 C-N-CA 123.301 2.667 . . . . 0.0 112.969 176.302 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -75.08 13.94 0.61 Allowed 'General case' 0 CA--C 1.558 1.267 0 CA-C-N 114.446 -1.252 . . . . 0.0 112.982 179.147 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 13.3 pt-20 -142.26 -9.97 0.86 Allowed 'General case' 0 N--CA 1.476 0.868 0 N-CA-C 112.371 0.508 . . . . 0.0 112.371 -175.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.483 1.201 0 CA-C-O 121.104 0.478 . . . . 0.0 111.067 -179.13 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.479 ' HB3' ' O ' ' A' ' 28' ' ' ASP . 1.9 mpt? . . . . . 0 N--CA 1.483 1.198 0 N-CA-C 109.32 -0.622 . . . . 0.0 109.32 . . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.4 m -120.73 122.87 41.35 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 123.226 0.61 . . . . 0.0 110.96 -172.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -99.42 137.46 37.89 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.479 0.711 . . . . 0.0 109.224 179.121 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.6 pttm -112.81 123.69 50.89 Favored 'General case' 0 C--O 1.238 0.485 0 N-CA-C 107.928 -1.138 . . . . 0.0 107.928 174.904 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.6 mp -105.93 123.31 60.41 Favored 'Isoleucine or valine' 0 C--O 1.222 -0.353 0 N-CA-C 106.779 -1.564 . . . . 0.0 106.779 -179.961 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 27.1 p90 -150.88 174.53 12.99 Favored 'General case' 0 C--N 1.325 -0.463 0 C-N-CA 124.224 1.01 . . . . 0.0 108.354 -177.748 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.665 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 59.2 ttt180 -139.73 98.08 7.98 Favored Pre-proline 0 C--O 1.242 0.688 0 N-CA-C 108.187 -1.042 . . . . 0.0 108.187 176.497 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.7 Cg_endo -80.74 174.91 10.56 Favored 'Trans proline' 0 C--N 1.366 1.498 0 C-N-CA 122.707 2.271 . . . . 0.0 112.186 -175.823 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.25 -18.12 60.17 Favored 'General case' 0 CA--C 1.552 1.053 0 C-N-CA 123.377 0.671 . . . . 0.0 111.035 177.434 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.8 ptmt -148.12 125.37 11.52 Favored 'General case' 0 CA--C 1.541 0.602 0 C-N-CA 124.588 1.155 . . . . 0.0 107.924 170.532 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 40.2 p -67.41 -79.48 0.05 OUTLIER 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.255 0.622 . . . . 0.0 111.308 -176.903 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 177.11 -64.6 0.01 OUTLIER 'General case' 0 N--CA 1.474 0.726 0 C-N-CA 124.939 1.295 . . . . 0.0 107.634 -175.85 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER -85.51 106.65 17.0 Favored 'General case' 0 CA--C 1.542 0.663 0 C-N-CA 124.157 0.983 . . . . 0.0 108.839 175.122 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . 0.422 ' HA ' ' OG1' ' A' ' 17' ' ' THR . 26.2 mm-40 -86.54 85.33 7.3 Favored 'General case' 0 CA--C 1.539 0.541 0 C-N-CA 123.122 0.569 . . . . 0.0 110.722 -174.674 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 42.9 m -93.83 -75.34 0.51 Allowed 'General case' 0 CA--C 1.544 0.723 0 CA-C-N 115.586 -0.734 . . . . 0.0 109.999 177.607 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -116.93 19.6 12.02 Favored Glycine 0 C--N 1.351 1.383 0 C-N-CA 123.667 0.651 . . . . 0.0 111.72 174.183 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.422 ' OG1' ' HA ' ' A' ' 14' ' ' GLN . 74.1 p -80.01 -9.23 59.68 Favored 'General case' 0 CA--C 1.542 0.672 0 C-N-CA 124.296 1.038 . . . . 0.0 111.963 -173.184 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -71.9 -23.92 61.56 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.184 0.594 . . . . 0.0 110.111 172.307 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 93.8 mttt -91.4 -64.7 1.09 Allowed 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.642 0.777 . . . . 0.0 108.949 173.578 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 22.5 p -140.48 127.42 20.69 Favored 'General case' 0 N--CA 1.48 1.029 0 C-N-CA 123.808 0.843 . . . . 0.0 110.334 178.857 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 43.0 m-80 -78.09 161.39 27.45 Favored 'General case' 0 N--CA 1.478 0.927 0 CA-C-O 121.39 0.614 . . . . 0.0 110.316 171.049 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 22.8 m -117.19 -175.07 0.8 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.756 0 CA-C-N 115.294 -0.866 . . . . 0.0 109.824 177.605 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.4 m95 -85.96 132.57 34.05 Favored 'General case' 0 CA--C 1.537 0.476 0 N-CA-C 108.564 -0.902 . . . . 0.0 108.564 -176.477 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 56.1 t -102.12 138.44 26.36 Favored 'Isoleucine or valine' 0 C--O 1.24 0.577 0 N-CA-C 108.98 -0.748 . . . . 0.0 108.98 175.784 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.489 HD22 HD23 ' A' ' 53' ' ' LEU . 9.1 tt -114.82 107.81 15.92 Favored 'General case' 0 CA--C 1.516 -0.361 0 N-CA-C 105.777 -1.935 . . . . 0.0 105.777 172.727 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 28.5 tt0 -108.7 134.84 50.88 Favored 'General case' 0 C--N 1.322 -0.62 0 N-CA-C 107.168 -1.419 . . . . 0.0 107.168 174.852 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.409 ' CE2' ' HA ' ' A' ' 29' ' ' ALA . 2.1 p90 -145.29 154.33 42.23 Favored 'General case' 0 N--CA 1.474 0.756 0 CA-C-N 118.546 0.612 . . . . 0.0 112.053 -176.439 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.479 ' O ' ' HB3' ' A' ' 1' ' ' MET . 23.8 t70 -61.23 108.07 0.85 Allowed 'General case' 0 CA--C 1.537 0.451 0 N-CA-C 106.97 -1.492 . . . . 0.0 106.97 162.49 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.409 ' HA ' ' CE2' ' A' ' 27' ' ' PHE . . . -61.96 152.11 33.11 Favored 'General case' 0 N--CA 1.478 0.969 0 N-CA-C 113.334 0.864 . . . . 0.0 113.334 -170.804 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -83.77 10.07 10.35 Favored 'General case' 0 CA--C 1.548 0.873 0 CA-C-N 114.714 -1.13 . . . . 0.0 112.05 -179.378 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.2 p -95.19 133.5 26.03 Favored Pre-proline 0 CA--C 1.555 1.171 0 N-CA-C 108.317 -0.994 . . . . 0.0 108.317 176.408 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 75.9 Cg_exo -54.49 171.26 0.44 Allowed 'Trans proline' 0 C--N 1.374 1.909 0 C-N-CA 123.38 2.72 . . . . 0.0 114.507 170.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 2.5 ppt_? -65.75 -14.33 61.1 Favored 'General case' 0 N--CA 1.49 1.534 0 CA-C-N 115.002 -0.999 . . . . 0.0 112.093 176.143 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.5 mmmt -71.69 109.29 5.5 Favored 'General case' 0 C--O 1.238 0.488 0 C-N-CA 123.935 0.894 . . . . 0.0 109.857 175.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 36.7 pt -94.02 162.36 2.42 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.903 0 C-N-CA 123.843 0.857 . . . . 0.0 110.757 178.459 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 14.8 t70 -88.85 149.13 43.01 Favored Pre-proline 0 CA--C 1.553 1.062 0 C-N-CA 123.577 0.751 . . . . 0.0 109.142 178.505 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -50.41 -33.76 38.9 Favored 'Trans proline' 0 C--N 1.381 2.265 0 C-N-CA 123.315 2.676 . . . . 0.0 114.17 173.735 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.4 mt -63.59 -42.28 95.57 Favored 'Isoleucine or valine' 0 N--CA 1.489 1.504 0 C-N-CA 122.994 0.518 . . . . 0.0 110.122 178.151 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 82.9 mtp -61.27 -59.01 5.97 Favored 'General case' 0 N--CA 1.478 0.97 0 C-N-CA 123.731 0.812 . . . . 0.0 109.893 178.221 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 63.14 24.95 67.67 Favored Glycine 0 CA--C 1.534 1.261 0 O-C-N 123.724 0.64 . . . . 0.0 114.409 175.139 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 44.7 t80 -84.09 68.12 9.96 Favored 'General case' 0 CA--C 1.551 0.991 0 C-N-CA 123.723 0.809 . . . . 0.0 110.11 -179.023 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 67.8 p -100.44 -5.56 26.93 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.586 0.754 . . . . 0.0 111.374 -178.297 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 31.4 p -60.89 -50.26 74.13 Favored 'General case' 0 N--CA 1.478 0.947 0 C-N-CA 123.726 0.811 . . . . 0.0 110.903 179.967 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 50.1 m -123.01 103.5 8.63 Favored 'General case' 0 N--CA 1.472 0.646 0 C-N-CA 124.164 0.986 . . . . 0.0 108.638 173.693 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 31.7 p -70.72 87.17 0.68 Allowed 'General case' 0 CA--C 1.54 0.594 0 C-N-CA 123.542 0.737 . . . . 0.0 110.203 178.668 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 13.5 t70 -92.11 166.46 12.64 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.53 0.732 . . . . 0.0 109.435 -179.398 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 31.0 mmt -68.81 -36.99 78.91 Favored 'General case' 0 N--CA 1.478 0.953 0 C-N-CA 122.818 0.447 . . . . 0.0 110.955 -179.699 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -178.35 156.26 0.95 Allowed 'General case' 0 N--CA 1.486 1.353 0 C-N-CA 124.176 0.991 . . . . 0.0 109.942 173.678 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.44 HE21 HG22 ' A' ' 51' ' ' VAL . 13.2 pt20 -69.79 106.71 3.22 Favored 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 115.914 -0.585 . . . . 0.0 109.466 173.213 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.7 pm0 -66.82 90.83 0.18 Allowed 'General case' 0 CA--C 1.553 1.066 0 CA-C-O 121.282 0.563 . . . . 0.0 109.683 176.533 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.44 HG22 HE21 ' A' ' 49' ' ' GLN . 58.6 t -70.05 160.73 4.86 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.977 0 C-N-CA 124.389 1.075 . . . . 0.0 111.546 -171.181 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 17.5 ptpt -133.69 132.43 40.65 Favored 'General case' 0 C--N 1.352 0.681 0 CA-C-O 121.771 0.796 . . . . 0.0 110.826 174.764 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.489 HD23 HD22 ' A' ' 25' ' ' LEU . 2.0 mm? -115.83 148.41 39.95 Favored 'General case' 0 CA--C 1.532 0.28 0 N-CA-C 107.258 -1.386 . . . . 0.0 107.258 -179.08 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 22.8 p -114.86 130.93 56.98 Favored 'General case' 0 CA--C 1.542 0.643 0 O-C-N 121.67 -0.644 . . . . 0.0 109.677 176.603 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.7 m-85 -130.84 146.48 52.29 Favored 'General case' 0 N--CA 1.472 0.674 0 C-N-CA 125.469 1.507 . . . . 0.0 108.32 179.587 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 46.7 mt-10 -68.63 -27.16 65.77 Favored 'General case' 0 N--CA 1.478 0.964 0 C-N-CA 122.797 0.439 . . . . 0.0 112.169 -175.908 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.4 p -134.3 159.28 41.48 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.629 0.771 . . . . 0.0 110.352 -178.986 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 41.0 tt0 -56.33 -46.29 79.96 Favored 'General case' 0 CA--C 1.545 0.787 0 C-N-CA 124.65 1.18 . . . . 0.0 111.4 172.115 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.6 mp0 -51.19 -45.42 61.81 Favored 'General case' 0 N--CA 1.485 1.299 0 O-C-N 124.909 1.381 . . . . 0.0 111.992 -177.579 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 21.5 mt-30 -70.85 -29.14 65.18 Favored 'General case' 0 CA--C 1.545 0.781 0 C-N-CA 123.609 0.764 . . . . 0.0 111.774 -177.696 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.66 -44.42 28.17 Favored 'General case' 0 N--CA 1.475 0.81 0 C-N-CA 123.033 0.533 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -70.49 -37.75 74.27 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 115.638 -0.71 . . . . 0.0 110.649 -177.301 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.35 -36.35 75.55 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 123.403 0.681 . . . . 0.0 112.302 174.778 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 53.6 t80 -62.66 -57.13 12.11 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 123.254 0.621 . . . . 0.0 109.905 177.883 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.58 -47.74 66.66 Favored 'General case' 0 CA--C 1.552 1.055 0 C-N-CA 124.494 1.117 . . . . 0.0 111.777 178.058 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.5 mt-30 -60.06 -45.92 91.26 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.248 1.019 . . . . 0.0 112.004 -179.496 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 27.7 ttm180 -60.54 -31.0 70.12 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.569 1.147 . . . . 0.0 111.172 -179.169 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 43.0 mmtm -87.84 -21.03 25.27 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 123.621 0.769 . . . . 0.0 111.059 178.414 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.52 -3.8 63.67 Favored Glycine 0 C--N 1.348 1.224 0 CA-C-O 119.984 -0.342 . . . . 0.0 112.628 -174.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 48.1 mt -63.14 108.89 0.64 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.113 0 CA-C-O 121.048 0.452 . . . . 0.0 109.873 -178.732 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.2 pt-20 -57.73 139.99 52.55 Favored 'General case' 0 N--CA 1.486 1.341 0 CA-C-N 114.014 -1.448 . . . . 0.0 108.489 172.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.0 p90 -142.18 147.8 37.19 Favored 'General case' 0 N--CA 1.472 0.672 0 CA-C-N 118.851 0.751 . . . . 0.0 112.102 -168.476 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 2.0 tmt_? -121.04 110.4 16.2 Favored 'General case' 0 CA--C 1.541 0.605 0 N-CA-C 107.883 -1.154 . . . . 0.0 107.883 175.065 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 58.4 t -83.73 135.54 24.6 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.531 0 N-CA-C 109.246 -0.65 . . . . 0.0 109.246 174.429 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 5.6 mt -121.65 129.17 75.76 Favored 'Isoleucine or valine' 0 C--O 1.242 0.71 0 C-N-CA 125.931 1.692 . . . . 0.0 108.04 -176.616 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 64.6 mt -59.58 133.89 88.9 Favored Pre-proline 0 CA--C 1.541 0.633 0 O-C-N 123.321 0.388 . . . . 0.0 110.863 175.724 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.665 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 76.9 Cg_endo -76.76 172.71 15.72 Favored 'Trans proline' 0 C--N 1.356 0.95 0 C-N-CA 122.856 2.37 . . . . 0.0 113.556 -175.983 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -26.94 68.76 Favored 'General case' 0 CA--C 1.555 1.162 0 CA-C-N 114.473 -1.239 . . . . 0.0 112.21 177.227 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -77.79 -24.65 48.79 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 123.427 0.691 . . . . 0.0 111.366 179.582 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.481 1.088 0 C-N-CA 123.076 0.55 . . . . 0.0 110.964 178.285 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.478 0.939 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.445 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 20.1 t -118.31 130.02 55.79 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 122.809 0.444 . . . . 0.0 109.884 -176.945 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.66 136.55 40.35 Favored 'General case' 0 N--CA 1.471 0.602 0 C-N-CA 123.608 0.763 . . . . 0.0 109.712 178.933 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.1 ptpp? -108.84 120.1 41.49 Favored 'General case' 0 C--O 1.238 0.47 0 N-CA-C 107.197 -1.409 . . . . 0.0 107.197 175.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.447 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.2 mp -104.54 123.15 58.29 Favored 'Isoleucine or valine' 0 CA--C 1.513 -0.475 0 N-CA-C 106.036 -1.838 . . . . 0.0 106.036 177.76 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.4 p90 -151.48 173.04 15.06 Favored 'General case' 0 C--N 1.315 -0.919 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -176.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.818 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 68.0 ttt180 -138.84 97.16 9.05 Favored Pre-proline 0 C--N 1.318 -0.771 0 N-CA-C 107.582 -1.266 . . . . 0.0 107.582 176.082 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 71.8 Cg_endo -72.7 147.76 45.65 Favored 'Trans proline' 0 C--N 1.365 1.421 0 C-N-CA 122.285 1.99 . . . . 0.0 111.502 -175.119 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -62.11 -34.82 77.05 Favored 'General case' 0 N--CA 1.471 0.608 0 CA-C-O 121.4 0.619 . . . . 0.0 109.604 169.846 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 16.6 ptmt -96.72 85.87 3.94 Favored 'General case' 0 CA--C 1.553 1.061 0 CA-C-N 114.813 -1.085 . . . . 0.0 110.294 175.142 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 14.5 p -95.2 -177.19 4.04 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 123.512 0.725 . . . . 0.0 109.884 172.474 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -63.88 140.35 58.86 Favored 'General case' 0 C--O 1.249 1.029 0 N-CA-C 109.475 -0.565 . . . . 0.0 109.475 170.962 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 43.3 mtm 67.41 32.4 5.83 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 124.834 1.254 . . . . 0.0 110.326 -177.822 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 45.5 tt0 -46.98 139.11 5.87 Favored 'General case' 0 N--CA 1.488 1.449 0 C-N-CA 125.204 1.402 . . . . 0.0 112.627 -176.388 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.8 t 82.45 -31.21 0.09 Allowed 'General case' 0 N--CA 1.49 1.531 0 C-N-CA 126.273 1.829 . . . . 0.0 111.569 179.5 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -108.36 17.99 33.5 Favored Glycine 0 C--N 1.35 1.341 0 N-CA-C 111.809 -0.516 . . . . 0.0 111.809 169.917 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 15.2 t -92.11 44.16 1.16 Allowed 'General case' 0 CA--C 1.555 1.161 0 C-N-CA 124.608 1.163 . . . . 0.0 110.424 -173.887 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -63.13 103.44 0.47 Allowed 'General case' 0 CA--C 1.543 0.692 0 CA-C-N 115.248 -0.887 . . . . 0.0 111.39 -177.407 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER 78.69 -32.94 0.16 Allowed 'General case' 0 N--CA 1.485 1.307 0 C-N-CA 125.726 1.61 . . . . 0.0 112.07 179.253 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 14.4 t -73.14 -1.99 19.74 Favored 'General case' 0 CA--C 1.558 1.279 0 C-N-CA 122.947 0.499 . . . . 0.0 111.117 174.01 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 27.3 t-20 -61.96 108.2 0.99 Allowed 'General case' 0 C--N 1.357 0.93 0 N-CA-C 107.772 -1.196 . . . . 0.0 107.772 160.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.451 HG23 HG22 ' A' ' 54' ' ' THR . 9.6 m -130.36 -179.08 2.94 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.031 0 C-N-CA 123.886 0.874 . . . . 0.0 110.938 -169.933 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 54.6 m95 -88.88 132.75 34.54 Favored 'General case' 0 C--N 1.347 0.498 0 C-N-CA 124.068 0.947 . . . . 0.0 109.338 -172.849 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 48.7 t -101.44 138.84 24.31 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.449 0 N-CA-C 108.941 -0.763 . . . . 0.0 108.941 175.182 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.511 ' HB2' ' HB1' ' A' ' 61' ' ' ALA . 53.8 tp -114.42 106.69 14.6 Favored 'General case' 0 CA--C 1.518 -0.269 0 C-N-CA 125.369 1.468 . . . . 0.0 107.17 176.279 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -115.46 132.38 56.64 Favored 'General case' 0 C--N 1.32 -0.69 0 N-CA-C 108.076 -1.083 . . . . 0.0 108.076 -179.841 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 44.5 p90 -145.75 156.83 43.86 Favored 'General case' 0 C--O 1.243 0.746 0 C-N-CA 123.357 0.663 . . . . 0.0 110.592 177.163 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -67.9 115.43 7.42 Favored 'General case' 0 C--O 1.239 0.516 0 N-CA-C 106.885 -1.524 . . . . 0.0 106.885 168.777 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -54.99 128.3 32.91 Favored 'General case' 0 N--CA 1.482 1.128 0 O-C-N 124.152 0.908 . . . . 0.0 111.697 -171.2 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.1 pt-20 -70.83 -4.63 25.18 Favored 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.839 0.856 . . . . 0.0 112.417 -178.332 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 14.6 p -74.23 138.35 75.31 Favored Pre-proline 0 CA--C 1.553 1.066 0 C-N-CA 123.114 0.565 . . . . 0.0 109.735 178.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 60.0 Cg_endo -71.27 -174.72 1.27 Allowed 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 122.386 2.057 . . . . 0.0 110.841 167.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.481 ' HB3' ' HA ' ' A' ' 47' ' ' MET . 3.8 ppt_? -72.3 80.82 1.01 Allowed 'General case' 0 CA--C 1.545 0.78 0 CA-C-O 122.548 1.166 . . . . 0.0 109.676 175.683 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 48.1 tptt -138.33 27.94 2.54 Favored 'General case' 0 CA--C 1.543 0.705 0 CA-C-N 114.305 -1.316 . . . . 0.0 108.173 -177.087 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 35.0 pt -72.94 162.94 4.2 Favored 'Isoleucine or valine' 0 C--O 1.243 0.758 0 CA-C-N 115.256 -0.883 . . . . 0.0 109.324 175.321 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 11.4 m-20 -72.73 125.11 91.37 Favored Pre-proline 0 CA--C 1.546 0.821 0 CA-C-N 116.633 -0.258 . . . . 0.0 110.466 -179.495 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 72.5 Cg_endo -71.62 -10.71 27.11 Favored 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 122.484 2.123 . . . . 0.0 111.783 175.8 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 47.4 mm -65.56 -27.65 42.17 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 124.856 1.262 . . . . 0.0 110.543 175.141 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 63.7 mtt -66.8 -61.63 1.86 Allowed 'General case' 0 N--CA 1.476 0.874 0 C-N-CA 123.408 0.683 . . . . 0.0 110.512 177.172 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 60.91 -161.9 23.19 Favored Glycine 0 C--N 1.349 1.252 0 O-C-N 123.588 0.555 . . . . 0.0 113.642 178.393 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 86.6 m-85 59.07 20.64 8.53 Favored 'General case' 0 N--CA 1.491 1.601 0 C-N-CA 124.955 1.302 . . . . 0.0 112.601 175.705 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.3 t -95.25 93.82 7.52 Favored 'General case' 0 CA--C 1.552 1.048 0 C-N-CA 123.932 0.893 . . . . 0.0 109.446 -177.953 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 57.2 p -65.77 -29.36 69.85 Favored 'General case' 0 C--N 1.355 0.821 0 CA-C-N 114.89 -1.05 . . . . 0.0 111.302 179.462 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 43.0 p -79.4 146.05 33.02 Favored 'General case' 0 C--O 1.242 0.68 0 C-N-CA 123.969 0.907 . . . . 0.0 110.277 174.211 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.5 m -74.29 79.11 1.83 Allowed 'General case' 0 N--CA 1.473 0.717 0 C-N-CA 123.307 0.643 . . . . 0.0 109.581 174.817 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 14.4 t70 -72.9 116.13 13.04 Favored 'General case' 0 C--O 1.238 0.468 0 CA-C-N 115.449 -0.796 . . . . 0.0 110.661 -173.111 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.481 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . 50.0 ttm -97.39 -29.39 13.53 Favored 'General case' 0 CA--C 1.543 0.709 0 N-CA-C 109.227 -0.657 . . . . 0.0 109.227 170.483 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -162.53 153.13 16.98 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 124.622 1.169 . . . . 0.0 108.192 171.971 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 4.4 pt20 -79.72 166.3 21.93 Favored 'General case' 0 CA--C 1.54 0.58 0 CA-C-N 115.98 -0.554 . . . . 0.0 109.756 172.253 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.6 pp0? -80.25 149.69 30.31 Favored 'General case' 0 N--CA 1.474 0.745 0 N-CA-C 107.606 -1.257 . . . . 0.0 107.606 163.251 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 7.3 p -138.31 145.33 28.57 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.63 0 N-CA-C 109.965 -0.383 . . . . 0.0 109.965 -178.577 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 11.6 ptmm? -138.79 138.69 37.82 Favored 'General case' 0 C--O 1.235 0.31 0 CA-C-N 115.424 -0.807 . . . . 0.0 110.515 176.669 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.3 mp -119.18 151.71 37.86 Favored 'General case' 0 CA--C 1.535 0.402 0 N-CA-C 106.773 -1.566 . . . . 0.0 106.773 175.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.451 HG22 HG23 ' A' ' 22' ' ' VAL . 0.2 OUTLIER -122.88 128.45 50.36 Favored 'General case' 0 N--CA 1.485 1.3 0 CA-C-N 118.644 0.657 . . . . 0.0 110.539 178.793 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.7 m-85 -129.05 154.88 46.24 Favored 'General case' 0 N--CA 1.468 0.467 0 C-N-CA 124.834 1.254 . . . . 0.0 108.999 -176.293 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.407 ' HB2' HE22 ' A' ' 60' ' ' GLN . 44.4 mm-40 -67.8 -29.6 68.81 Favored 'General case' 0 CA--C 1.544 0.725 0 O-C-N 123.569 0.543 . . . . 0.0 111.874 -177.424 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 56.7 p -133.04 161.14 35.15 Favored 'General case' 0 C--O 1.243 0.728 0 C-N-CA 123.43 0.692 . . . . 0.0 111.079 -176.545 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.4 tt0 -54.63 -48.99 71.57 Favored 'General case' 0 N--CA 1.478 0.938 0 CA-C-N 114.439 -1.255 . . . . 0.0 111.117 168.279 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 38.8 mt-10 -45.37 -46.16 12.97 Favored 'General case' 0 N--CA 1.472 0.641 0 C-N-CA 126.08 1.752 . . . . 0.0 113.288 -178.143 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.407 HE22 ' HB2' ' A' ' 56' ' ' GLU . 47.5 mt-30 -70.32 -33.82 71.96 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.11 0.564 . . . . 0.0 112.039 -178.476 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.511 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -80.42 -38.06 30.93 Favored 'General case' 0 N--CA 1.478 0.968 0 CA-C-O 121.305 0.574 . . . . 0.0 110.753 -174.286 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.4 pt-20 -72.1 -40.25 68.31 Favored 'General case' 0 C--O 1.222 -0.367 0 CA-C-N 115.058 -0.974 . . . . 0.0 110.387 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -59.1 -33.52 70.94 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 123.254 0.622 . . . . 0.0 112.118 175.649 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.0 t80 -63.81 -57.1 10.94 Favored 'General case' 0 C--N 1.352 0.695 0 N-CA-C 109.31 -0.626 . . . . 0.0 109.31 176.468 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -52.89 -46.46 67.98 Favored 'General case' 0 CA--C 1.552 1.054 0 C-N-CA 124.494 1.118 . . . . 0.0 112.223 177.809 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.7 mt-30 -60.12 -47.69 84.87 Favored 'General case' 0 N--CA 1.486 1.351 0 C-N-CA 124.41 1.084 . . . . 0.0 110.995 178.981 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 59.6 ttt180 -57.84 -36.28 72.08 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.779 1.232 . . . . 0.0 111.253 177.768 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.4 mmtt -80.96 -25.38 37.41 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 123.594 0.758 . . . . 0.0 111.011 179.373 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 97.29 -5.55 63.0 Favored Glycine 0 C--N 1.352 1.443 0 C-N-CA 123.032 0.349 . . . . 0.0 112.499 -171.362 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.9 mt -62.72 110.62 0.75 Allowed 'Isoleucine or valine' 0 CA--C 1.56 1.343 0 C-N-CA 123.399 0.68 . . . . 0.0 110.79 -177.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.445 ' O ' ' HA ' ' A' ' 2' ' ' SER . 1.6 pm0 -54.19 138.91 37.24 Favored 'General case' 0 N--CA 1.488 1.449 0 CA-C-N 113.645 -1.616 . . . . 0.0 109.343 169.992 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 46.5 p90 -148.21 151.2 35.1 Favored 'General case' 0 N--CA 1.476 0.841 0 CA-C-N 119.0 0.818 . . . . 0.0 112.087 -170.241 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.511 HH11 HG13 ' A' ' 75' ' ' ILE . 1.2 tmt_? -121.56 125.71 47.41 Favored 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 124.091 0.956 . . . . 0.0 108.651 171.58 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.447 HG12 ' HB ' ' A' ' 5' ' ' ILE . 33.9 m -93.49 137.88 21.59 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.099 0 C-N-CA 123.68 0.792 . . . . 0.0 110.315 176.901 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.511 HG13 HH11 ' A' ' 73' ' ' ARG . 4.1 mp -121.1 137.32 55.19 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.815 0 C-N-CA 124.576 1.15 . . . . 0.0 108.325 -178.423 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 82.1 mt -74.84 142.48 76.75 Favored Pre-proline 0 CA--C 1.547 0.854 0 C-N-CA 123.855 0.862 . . . . 0.0 111.469 -178.839 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.818 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 91.4 Cg_endo -79.66 -165.82 0.37 Allowed 'Trans proline' 0 C--N 1.373 1.835 0 C-N-CA 123.355 2.703 . . . . 0.0 112.88 -178.432 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -76.15 16.67 0.42 Allowed 'General case' 0 CA--C 1.561 1.389 0 C-N-CA 124.104 0.962 . . . . 0.0 113.14 179.079 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.406 ' HG3' ' H ' ' A' ' 80' ' ' ALA . 6.3 pt-20 -147.17 -63.56 0.28 Allowed 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 123.846 0.858 . . . . 0.0 109.554 -177.77 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.513 ' HB2' ' HD2' ' A' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.48 1.042 0 C-N-CA 124.091 0.956 . . . . 0.0 112.225 176.281 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.636 ' HA ' ' HB2' ' A' ' 28' ' ' ASP . 80.3 mtp . . . . . 0 N--CA 1.479 0.989 0 N-CA-C 108.8 -0.815 . . . . 0.0 108.8 . . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 36.7 m -116.02 125.91 53.09 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 124.219 1.008 . . . . 0.0 108.791 179.549 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.478 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -99.96 129.02 45.99 Favored 'General case' 0 C--O 1.217 -0.607 0 C-N-CA 123.607 0.763 . . . . 0.0 109.973 -177.851 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . 0.484 ' HA ' ' O ' ' A' ' 73' ' ' ARG . 0.0 OUTLIER -114.6 119.87 38.25 Favored 'General case' 0 CA--C 1.544 0.722 0 C-N-CA 123.988 0.915 . . . . 0.0 108.587 179.103 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.496 HG13 HD13 ' A' ' 25' ' ' LEU . 3.6 mp -106.81 122.69 61.15 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.609 0 N-CA-C 106.799 -1.556 . . . . 0.0 106.799 -176.274 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 14.8 p90 -150.14 161.89 41.51 Favored 'General case' 0 N--CA 1.47 0.553 0 CA-C-O 121.4 0.619 . . . . 0.0 111.73 -172.233 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.682 ' HE ' ' HB2' ' A' ' 21' ' ' ASN . 26.0 mtp180 -119.51 103.54 46.49 Favored Pre-proline 0 N--CA 1.472 0.643 0 CA-C-N 114.82 -1.082 . . . . 0.0 108.482 168.942 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.495 ' HG2' ' HA ' ' A' ' 11' ' ' THR . 61.5 Cg_endo -75.59 139.18 22.53 Favored 'Trans proline' 0 CA--C 1.55 1.281 0 C-N-CA 122.265 1.977 . . . . 0.0 112.015 -179.878 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -69.65 -11.02 60.51 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 123.939 0.895 . . . . 0.0 111.196 173.614 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 14.8 ptmt -128.34 94.01 3.79 Favored 'General case' 0 CA--C 1.543 0.701 0 N-CA-C 107.493 -1.299 . . . . 0.0 107.493 164.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.495 ' HA ' ' HG2' ' A' ' 8' ' ' PRO . 59.4 m -83.93 138.42 33.16 Favored 'General case' 0 C--O 1.244 0.77 0 CA-C-N 115.903 -0.59 . . . . 0.0 110.425 -177.352 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -59.14 119.88 8.16 Favored 'General case' 0 C--N 1.353 0.72 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 171.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 62.0 mtt -71.4 90.78 0.98 Allowed 'General case' 0 C--O 1.24 0.594 0 O-C-N 124.176 0.922 . . . . 0.0 110.85 -171.376 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 29.5 tt0 -74.32 -36.44 63.7 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 114.761 -1.109 . . . . 0.0 108.728 169.879 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.2 p -156.43 151.6 26.43 Favored 'General case' 0 C--O 1.244 0.794 0 C-N-CA 124.696 1.199 . . . . 0.0 108.321 170.204 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -77.56 71.47 2.31 Favored Glycine 0 C--N 1.343 0.956 0 N-CA-C 112.286 -0.326 . . . . 0.0 112.286 -178.479 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.6 t -154.85 19.22 0.45 Allowed 'General case' 0 CA--C 1.546 0.823 0 C-N-CA 124.078 0.951 . . . . 0.0 110.316 -177.18 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -81.75 70.91 8.74 Favored 'General case' 0 CA--C 1.549 0.927 0 CA-C-O 121.08 0.467 . . . . 0.0 111.548 -173.702 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 12.1 mptt -91.63 -65.63 0.99 Allowed 'General case' 0 N--CA 1.473 0.719 0 N-CA-C 107.003 -1.48 . . . . 0.0 107.003 168.227 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 16.7 p -79.7 94.26 5.69 Favored 'General case' 0 CA--C 1.539 0.53 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 164.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.682 ' HB2' ' HE ' ' A' ' 7' ' ' ARG . 11.3 m120 -66.83 141.91 57.52 Favored 'General case' 0 N--CA 1.477 0.895 0 CA-C-N 115.716 -0.675 . . . . 0.0 111.028 -170.798 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.411 HG21 ' HB ' ' A' ' 54' ' ' THR . 14.7 p -73.81 149.92 7.79 Favored 'Isoleucine or valine' 0 C--O 1.244 0.8 0 C-N-CA 123.337 0.655 . . . . 0.0 109.768 177.266 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 72.5 m95 -85.04 127.3 34.16 Favored 'General case' 0 C--N 1.353 0.731 0 N-CA-C 107.88 -1.156 . . . . 0.0 107.88 177.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 38.6 t -101.43 136.94 30.9 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.536 0 N-CA-C 107.925 -1.139 . . . . 0.0 107.925 -179.11 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.581 HD23 HD12 ' A' ' 53' ' ' LEU . 58.8 tp -118.26 104.12 10.48 Favored 'General case' 0 CA--C 1.534 0.331 0 C-N-CA 124.986 1.315 . . . . 0.0 108.715 -179.015 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.58 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 43.4 mt-10 -104.68 136.92 43.31 Favored 'General case' 0 C--O 1.212 -0.921 0 N-CA-C 107.603 -1.258 . . . . 0.0 107.603 177.218 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 41.1 p90 -143.77 149.86 37.72 Favored 'General case' 0 N--CA 1.476 0.844 0 CA-C-N 118.499 0.591 . . . . 0.0 109.918 174.473 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.636 ' HB2' ' HA ' ' A' ' 1' ' ' MET . 8.3 m-20 -61.76 94.15 0.05 OUTLIER 'General case' 0 N--CA 1.472 0.657 0 C-N-CA 123.863 0.865 . . . . 0.0 110.272 177.77 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.4 ' HB1' HG12 ' A' ' 31' ' ' VAL . . . -88.7 137.63 32.15 Favored 'General case' 0 C--O 1.235 0.319 0 N-CA-C 108.966 -0.753 . . . . 0.0 108.966 179.144 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.8 pt-20 -83.24 9.78 9.93 Favored 'General case' 0 CA--C 1.55 0.952 0 C-N-CA 123.495 0.718 . . . . 0.0 111.315 -176.527 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.4 HG12 ' HB1' ' A' ' 29' ' ' ALA . 7.7 p -89.17 117.01 67.83 Favored Pre-proline 0 CA--C 1.562 1.433 0 C-N-CA 123.673 0.789 . . . . 0.0 110.621 179.149 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.41 ' O ' HG23 ' A' ' 35' ' ' ILE . 45.8 Cg_endo -85.26 -149.97 0.04 OUTLIER 'Trans proline' 0 C--N 1.377 2.058 0 C-N-CA 123.263 2.642 . . . . 0.0 112.374 176.516 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -54.79 -15.76 2.13 Favored 'General case' 0 N--CA 1.49 1.54 0 C-N-CA 123.694 0.798 . . . . 0.0 112.493 170.55 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 52.9 tptt -78.82 61.18 3.01 Favored 'General case' 0 CA--C 1.559 1.305 0 C-N-CA 124.041 0.936 . . . . 0.0 109.097 170.774 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.41 HG23 ' O ' ' A' ' 32' ' ' PRO . 1.4 pp -88.87 -165.59 0.1 Allowed 'Isoleucine or valine' 0 N--CA 1.484 1.264 0 C-N-CA 124.643 1.177 . . . . 0.0 111.159 -179.442 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 5.0 m-20 -56.33 115.78 10.88 Favored Pre-proline 0 CA--C 1.553 1.058 0 C-N-CA 123.272 0.629 . . . . 0.0 110.776 173.218 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 88.6 Cg_endo -72.5 -7.47 20.93 Favored 'Trans proline' 0 C--N 1.377 2.029 0 C-N-CA 122.658 2.239 . . . . 0.0 112.193 178.956 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 46.6 mm -59.82 -54.67 31.46 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 C-N-CA 124.837 1.255 . . . . 0.0 111.029 -178.594 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 19.0 ptp -106.71 -58.72 1.89 Allowed 'General case' 0 CA--C 1.552 1.04 0 C-N-CA 123.151 0.58 . . . . 0.0 110.302 178.943 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 70.27 114.76 0.04 OUTLIER Glycine 0 C--N 1.356 1.647 0 CA-C-O 119.961 -0.355 . . . . 0.0 113.508 -178.739 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 50.7 p90 -137.28 29.23 2.74 Favored 'General case' 0 N--CA 1.486 1.374 0 CA-C-N 117.548 0.674 . . . . 0.0 111.31 -177.4 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 73.6 p -62.8 145.19 55.52 Favored 'General case' 0 N--CA 1.48 1.064 0 C-N-CA 123.394 0.678 . . . . 0.0 112.127 -175.903 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 56.0 p -73.26 -53.49 10.74 Favored 'General case' 0 C--O 1.242 0.659 0 N-CA-C 109.346 -0.613 . . . . 0.0 109.346 174.874 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 37.4 t -173.71 -82.69 0.01 OUTLIER 'General case' 0 CA--C 1.546 0.821 0 C-N-CA 124.002 0.921 . . . . 0.0 109.254 175.665 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 27.3 t -116.17 38.4 3.39 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.282 1.033 . . . . 0.0 109.625 -174.158 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 4.2 p-10 -71.12 145.18 49.96 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.699 0.799 . . . . 0.0 111.796 -176.46 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.7 mmt -99.29 -173.48 2.5 Favored 'General case' 0 N--CA 1.484 1.231 0 C-N-CA 124.305 1.042 . . . . 0.0 111.713 -171.587 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -54.35 90.61 0.01 OUTLIER 'General case' 0 N--CA 1.487 1.381 0 C-N-CA 124.583 1.153 . . . . 0.0 112.708 -174.696 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -75.49 151.98 37.93 Favored 'General case' 0 N--CA 1.474 0.738 0 CA-C-N 114.426 -1.261 . . . . 0.0 111.022 -175.818 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.7 pm0 -82.29 116.62 21.88 Favored 'General case' 0 CA--C 1.54 0.57 0 N-CA-C 107.741 -1.207 . . . . 0.0 107.741 169.188 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 23.9 m -87.68 165.02 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.671 0 O-C-N 121.431 -0.793 . . . . 0.0 109.779 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.58 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 0.1 OUTLIER -135.94 140.27 43.89 Favored 'General case' 0 CA--C 1.538 0.499 0 CA-C-O 121.563 0.696 . . . . 0.0 112.034 -174.151 . . . . . . . . 3 3 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.581 HD12 HD23 ' A' ' 25' ' ' LEU . 50.6 mt -116.81 156.01 27.98 Favored 'General case' 0 CA--C 1.536 0.422 0 C-N-CA 125.609 1.564 . . . . 0.0 107.403 177.207 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.411 ' HB ' HG21 ' A' ' 22' ' ' VAL . 18.7 p -119.9 133.57 55.53 Favored 'General case' 0 N--CA 1.481 1.092 0 O-C-N 121.655 -0.653 . . . . 0.0 110.623 174.657 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.431 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 96.0 m-85 -135.54 147.67 48.85 Favored 'General case' 0 N--CA 1.475 0.821 0 C-N-CA 124.886 1.275 . . . . 0.0 109.277 -179.862 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.414 ' HB2' HE22 ' A' ' 60' ' ' GLN . 18.7 mm-40 -67.6 -24.62 65.51 Favored 'General case' 0 N--CA 1.48 1.06 0 O-C-N 123.601 0.563 . . . . 0.0 111.755 -174.409 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 76.1 p -134.44 163.13 30.37 Favored 'General case' 0 N--CA 1.478 0.929 0 C-N-CA 123.398 0.679 . . . . 0.0 110.2 179.013 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 24.6 tt0 -61.63 -39.5 91.5 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 123.471 0.708 . . . . 0.0 110.392 172.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.3 mt-10 -52.14 -44.62 64.65 Favored 'General case' 0 N--CA 1.477 0.924 0 O-C-N 124.747 1.279 . . . . 0.0 112.559 -176.263 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.431 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 48.3 mt-30 -70.97 -30.39 66.65 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.543 0.737 . . . . 0.0 111.976 -177.143 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.87 -38.61 25.12 Favored 'General case' 0 N--CA 1.485 1.321 0 C-N-CA 123.306 0.643 . . . . 0.0 111.301 -177.907 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.9 pt-20 -76.09 -39.02 56.27 Favored 'General case' 0 N--CA 1.469 0.504 0 CA-C-N 114.951 -1.022 . . . . 0.0 110.82 -179.596 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -64.63 -30.68 71.71 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 123.727 0.811 . . . . 0.0 111.695 175.521 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.2 t80 -64.42 -53.42 48.62 Favored 'General case' 0 C--N 1.354 0.803 0 N-CA-C 109.081 -0.711 . . . . 0.0 109.081 174.899 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.43 -43.93 75.81 Favored 'General case' 0 CA--C 1.55 0.969 0 C-N-CA 124.214 1.005 . . . . 0.0 111.724 177.866 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.6 mt-30 -64.56 -44.57 90.33 Favored 'General case' 0 N--CA 1.483 1.196 0 C-N-CA 124.35 1.06 . . . . 0.0 111.663 -179.445 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 77.0 ttt180 -64.39 -28.78 69.92 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 123.757 0.823 . . . . 0.0 110.659 177.93 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.0 mmtt -89.18 -16.84 30.4 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 123.451 0.7 . . . . 0.0 111.072 177.455 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.23 -7.49 81.44 Favored Glycine 0 C--N 1.35 1.335 0 C-N-CA 123.261 0.458 . . . . 0.0 112.89 -176.523 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.2 mt -59.35 112.01 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.554 1.116 0 C-N-CA 123.233 0.613 . . . . 0.0 110.458 -176.751 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.1 pt-20 -55.13 135.83 48.9 Favored 'General case' 0 N--CA 1.483 1.212 0 CA-C-N 113.341 -1.754 . . . . 0.0 108.646 173.437 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 37.3 p90 -141.22 144.9 34.99 Favored 'General case' 0 N--CA 1.475 0.812 0 CA-C-N 119.492 1.042 . . . . 0.0 112.505 -170.348 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.484 ' O ' ' HA ' ' A' ' 4' ' ' LYS . 18.7 tpp180 -116.92 138.11 51.76 Favored 'General case' 0 CA--C 1.538 0.484 0 C-N-CA 125.52 1.528 . . . . 0.0 108.298 170.515 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.485 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -105.06 133.34 49.55 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.967 0 CA-C-O 121.113 0.482 . . . . 0.0 110.328 174.997 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.3 mp -104.12 112.26 36.98 Favored 'Isoleucine or valine' 0 C--O 1.239 0.505 0 N-CA-C 106.767 -1.568 . . . . 0.0 106.767 174.385 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.1 mt -71.14 147.39 93.46 Favored Pre-proline 0 CA--C 1.543 0.694 0 C-N-CA 123.747 0.819 . . . . 0.0 111.328 -175.793 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.411 ' HD2' ' HB2' ' A' ' 80' ' ' ALA . 98.5 Cg_endo -76.9 177.05 9.36 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.414 2.076 . . . . 0.0 111.889 179.334 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.41 -27.75 69.31 Favored 'General case' 0 CA--C 1.554 1.101 0 C-N-CA 123.621 0.768 . . . . 0.0 111.655 -179.393 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 11.1 pt-20 -97.6 13.95 28.33 Favored 'General case' 0 N--CA 1.484 1.234 0 C-N-CA 124.644 1.177 . . . . 0.0 112.203 -174.118 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.411 ' HB2' ' HD2' ' A' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.478 0.974 0 C-N-CA 122.767 0.427 . . . . 0.0 111.384 176.653 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.8 OUTLIER . . . . . 0 N--CA 1.482 1.162 0 N-CA-C 108.747 -0.834 . . . . 0.0 108.747 . . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 11.7 p -135.38 102.53 5.18 Favored 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 108.127 -1.064 . . . . 0.0 108.127 -175.803 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -101.2 138.61 38.01 Favored 'General case' 0 N--CA 1.474 0.744 0 CA-C-N 116.28 -0.418 . . . . 0.0 110.964 -167.058 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.1 ptpp? -107.23 122.04 45.74 Favored 'General case' 0 C--O 1.24 0.557 0 N-CA-C 106.895 -1.52 . . . . 0.0 106.895 175.082 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.507 HG13 HD23 ' A' ' 25' ' ' LEU . 4.3 mp -103.44 122.95 56.64 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.528 0 N-CA-C 106.159 -1.793 . . . . 0.0 106.159 176.178 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 33.6 p90 -150.15 178.15 9.25 Favored 'General case' 0 C--N 1.313 -1.016 0 N-CA-C 108.387 -0.968 . . . . 0.0 108.387 -179.503 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.63 ' HB3' ' HG3' ' A' ' 77' ' ' PRO . 15.6 ttt180 -136.89 97.14 11.27 Favored Pre-proline 0 C--N 1.311 -1.103 0 N-CA-C 105.535 -2.024 . . . . 0.0 105.535 179.415 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 36.5 Cg_endo -61.9 116.99 3.81 Favored 'Trans proline' 0 C--N 1.366 1.492 0 C-N-CA 122.913 2.409 . . . . 0.0 113.211 -165.554 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -75.21 -15.5 60.54 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 123.377 0.671 . . . . 0.0 110.649 171.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.4 ptmt -70.6 -29.21 65.55 Favored 'General case' 0 CA--C 1.548 0.879 0 C-N-CA 124.409 1.083 . . . . 0.0 111.117 173.955 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 73.7 p -78.52 137.3 37.85 Favored 'General case' 0 C--N 1.36 1.055 0 N-CA-C 109.726 -0.472 . . . . 0.0 109.726 172.994 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.64 -155.21 0.29 Allowed 'General case' 0 CA--C 1.548 0.876 0 C-N-CA 123.868 0.867 . . . . 0.0 110.129 175.905 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 26.5 ptt? -54.79 -23.65 19.04 Favored 'General case' 0 N--CA 1.486 1.333 0 C-N-CA 124.213 1.005 . . . . 0.0 112.933 177.315 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 44.5 mt-30 -72.08 89.0 1.12 Allowed 'General case' 0 N--CA 1.481 1.113 0 C-N-CA 123.704 0.802 . . . . 0.0 109.894 177.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 34.3 t -126.92 -4.26 6.37 Favored 'General case' 0 CA--C 1.551 1.014 0 C-N-CA 124.261 1.024 . . . . 0.0 110.715 -177.457 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 72.2 35.62 60.51 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 116.15 -0.477 . . . . 0.0 112.893 -178.609 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 10.6 t -163.68 -162.27 0.71 Allowed 'General case' 0 CA--C 1.557 1.234 0 C-N-CA 124.76 1.224 . . . . 0.0 108.534 -177.642 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -64.57 170.54 3.93 Favored 'General case' 0 N--CA 1.484 1.263 0 CA-C-N 118.231 0.469 . . . . 0.0 109.876 168.568 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 37.7 ttmt -69.25 83.19 0.36 Allowed 'General case' 0 N--CA 1.481 1.119 0 CA-C-O 121.665 0.745 . . . . 0.0 110.766 -174.318 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 11.5 t -164.78 136.93 4.48 Favored 'General case' 0 C--O 1.238 0.484 0 CA-C-N 114.605 -1.18 . . . . 0.0 108.565 178.084 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -68.31 132.05 46.42 Favored 'General case' 0 C--O 1.236 0.38 0 C-N-CA 123.177 0.591 . . . . 0.0 109.912 -179.479 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.463 HG21 ' HB ' ' A' ' 54' ' ' THR . 14.1 p -82.54 156.91 3.93 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.74 0 N-CA-C 109.101 -0.703 . . . . 0.0 109.101 176.491 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.426 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 67.8 m95 -88.72 131.86 34.85 Favored 'General case' 0 CA--C 1.542 0.641 0 N-CA-C 108.777 -0.823 . . . . 0.0 108.777 175.099 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 97.5 t -101.14 139.88 21.3 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.632 0 N-CA-C 109.467 -0.568 . . . . 0.0 109.467 176.244 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.507 HD23 HG13 ' A' ' 5' ' ' ILE . 3.2 tm? -114.64 104.35 11.9 Favored 'General case' 0 C--N 1.343 0.286 0 N-CA-C 105.828 -1.915 . . . . 0.0 105.828 174.563 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 31.1 tt0 -113.35 131.73 55.85 Favored 'General case' 0 N--CA 1.475 0.79 0 N-CA-C 108.647 -0.871 . . . . 0.0 108.647 -177.195 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 42.2 p90 -143.04 154.98 44.53 Favored 'General case' 0 N--CA 1.476 0.843 0 C-N-CA 123.597 0.759 . . . . 0.0 110.715 178.266 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 11.2 p-10 -69.9 115.24 8.9 Favored 'General case' 0 CA--C 1.544 0.746 0 N-CA-C 108.941 -0.762 . . . . 0.0 108.941 170.05 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.577 ' HB2' HG23 ' A' ' 51' ' ' VAL . . . -70.86 140.66 51.18 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.847 0.859 . . . . 0.0 111.382 -177.577 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 13.5 pt-20 -72.0 0.07 10.32 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 123.667 0.787 . . . . 0.0 112.807 -175.582 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.2 p -70.57 128.32 91.18 Favored Pre-proline 0 CA--C 1.546 0.822 0 C-N-CA 123.682 0.793 . . . . 0.0 109.661 -176.345 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 29.7 Cg_exo -64.42 -163.17 0.05 OUTLIER 'Trans proline' 0 CA--C 1.551 1.366 0 C-N-CA 123.037 2.492 . . . . 0.0 113.16 170.108 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.62 ' HB3' ' HA ' ' A' ' 46' ' ' ASP . 6.0 ppt_? -65.07 -10.35 29.56 Favored 'General case' 0 CA--C 1.557 1.229 0 CA-C-N 114.915 -1.038 . . . . 0.0 112.519 169.281 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 4.5 tppp? -62.17 97.85 0.1 Allowed 'General case' 0 C--N 1.354 0.799 0 C-N-CA 124.4 1.08 . . . . 0.0 111.038 -179.522 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.686 HG21 ' HA ' ' A' ' 41' ' ' TYR . 36.6 pt -84.58 166.99 1.97 Allowed 'Isoleucine or valine' 0 C--O 1.241 0.624 0 CA-C-N 115.027 -0.988 . . . . 0.0 110.922 176.951 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 36.7 m-20 -83.02 126.14 73.22 Favored Pre-proline 0 CA--C 1.546 0.796 0 N-CA-C 108.019 -1.104 . . . . 0.0 108.019 165.136 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 50.3 Cg_endo -66.31 -2.66 7.46 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.574 2.182 . . . . 0.0 114.243 -178.052 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 33.7 mm -59.99 -48.92 85.99 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.117 0 C-N-CA 123.126 0.57 . . . . 0.0 109.712 165.135 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.4 ptm -107.49 179.8 4.14 Favored 'General case' 0 N--CA 1.478 0.97 0 CA-C-N 115.397 -0.819 . . . . 0.0 111.481 -174.604 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -84.78 -172.57 49.24 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-N 115.73 -0.668 . . . . 0.0 113.468 -179.327 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.686 ' HA ' HG21 ' A' ' 35' ' ' ILE . 66.8 t80 -98.4 -33.55 11.0 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 124.025 0.93 . . . . 0.0 112.65 -173.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 14.9 t -63.14 -14.97 55.0 Favored 'General case' 0 N--CA 1.488 1.445 0 N-CA-C 113.727 1.01 . . . . 0.0 113.727 -166.447 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 49.8 m -73.73 -24.42 59.9 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 123.135 0.574 . . . . 0.0 112.515 177.236 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 47.5 p -139.73 114.77 9.62 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 123.852 0.861 . . . . 0.0 109.794 178.502 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 21.1 t -81.65 -173.7 4.57 Favored 'General case' 0 CA--C 1.553 1.094 0 C-N-CA 123.754 0.822 . . . . 0.0 110.7 -179.39 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.62 ' HA ' ' HB3' ' A' ' 33' ' ' ARG . 3.1 m-20 -57.02 -24.07 51.01 Favored 'General case' 0 N--CA 1.486 1.34 0 C-N-CA 124.573 1.149 . . . . 0.0 113.412 -176.125 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 3.9 mpp? -74.68 -77.41 0.12 Allowed 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.407 0.283 . . . . 0.0 110.281 176.305 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 9.2 ptmt -179.8 -166.37 0.08 Allowed 'General case' 0 N--CA 1.48 1.073 0 C-N-CA 124.354 1.062 . . . . 0.0 109.304 -169.211 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -136.17 -173.98 3.55 Favored 'General case' 0 N--CA 1.477 0.91 0 C-N-CA 123.671 0.789 . . . . 0.0 108.875 169.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 5.4 pm0 -106.15 162.31 13.75 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.301 0.64 . . . . 0.0 110.246 176.054 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.577 HG23 ' HB2' ' A' ' 29' ' ' ALA . 46.3 t -137.71 147.0 26.56 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.122 0 C-N-CA 124.975 1.31 . . . . 0.0 107.862 172.809 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.424 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 14.7 ptpt -144.0 139.01 28.8 Favored 'General case' 0 N--CA 1.47 0.546 0 CA-C-O 121.588 0.708 . . . . 0.0 111.796 178.95 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 44.5 mt -118.47 157.79 26.58 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 125.469 1.507 . . . . 0.0 108.026 -179.077 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.463 ' HB ' HG21 ' A' ' 22' ' ' VAL . 34.7 p -119.01 135.09 54.8 Favored 'General case' 0 N--CA 1.472 0.661 0 C-N-CA 123.177 0.591 . . . . 0.0 109.956 175.164 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.54 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 97.9 m-85 -138.38 148.45 44.52 Favored 'General case' 0 N--CA 1.478 0.972 0 C-N-CA 125.206 1.402 . . . . 0.0 109.787 -178.342 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.432 ' HB2' HE22 ' A' ' 60' ' ' GLN . 35.4 mt-10 -63.14 -32.98 74.49 Favored 'General case' 0 N--CA 1.489 1.491 0 C-N-CA 123.353 0.661 . . . . 0.0 111.896 -174.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 25.9 p -134.65 164.12 28.22 Favored 'General case' 0 N--CA 1.477 0.884 0 C-N-CA 123.658 0.783 . . . . 0.0 111.274 -176.791 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 49.4 tt0 -58.2 -46.1 86.42 Favored 'General case' 0 N--CA 1.475 0.783 0 CA-C-N 114.404 -1.271 . . . . 0.0 111.137 173.96 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.3 mt-10 -48.42 -43.81 34.58 Favored 'General case' 0 N--CA 1.479 0.985 0 O-C-N 124.999 1.437 . . . . 0.0 112.811 178.834 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.54 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 78.2 mt-30 -70.12 -35.15 73.9 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.529 0.731 . . . . 0.0 111.774 -176.796 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.419 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -76.84 -39.12 52.3 Favored 'General case' 0 N--CA 1.478 0.949 0 CA-C-O 121.491 0.662 . . . . 0.0 110.653 -175.571 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 11.9 pt-20 -77.07 -30.22 55.43 Favored 'General case' 0 N--CA 1.467 0.391 0 CA-C-N 114.499 -1.228 . . . . 0.0 111.776 176.304 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.09 -36.0 76.42 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 123.296 0.639 . . . . 0.0 111.757 173.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 79.3 t80 -62.2 -58.44 7.76 Favored 'General case' 0 C--N 1.35 0.608 0 N-CA-C 109.267 -0.642 . . . . 0.0 109.267 174.662 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.58 -48.09 63.27 Favored 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.948 1.299 . . . . 0.0 112.423 -179.914 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -61.06 -46.1 92.05 Favored 'General case' 0 N--CA 1.484 1.233 0 C-N-CA 124.318 1.047 . . . . 0.0 111.392 -179.998 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 41.8 ttm180 -59.56 -34.85 73.21 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.536 1.135 . . . . 0.0 111.242 178.225 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 32.7 mmtp -87.66 -20.49 26.24 Favored 'General case' 0 CA--C 1.547 0.829 0 C-N-CA 123.84 0.856 . . . . 0.0 111.587 -179.442 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 93.57 -1.93 69.7 Favored Glycine 0 C--N 1.352 1.459 0 O-C-N 123.172 0.295 . . . . 0.0 113.143 -174.504 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 70.8 mt -59.07 112.24 0.59 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.056 0 C-N-CA 123.525 0.73 . . . . 0.0 110.939 -178.794 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -58.0 138.1 56.23 Favored 'General case' 0 N--CA 1.492 1.635 0 CA-C-N 114.125 -1.398 . . . . 0.0 108.281 169.861 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 52.4 p90 -146.71 148.84 32.41 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 118.719 0.69 . . . . 0.0 112.658 -172.964 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 27.4 tpt180 -114.18 122.96 48.39 Favored 'General case' 0 CA--C 1.545 0.758 0 C-N-CA 125.007 1.323 . . . . 0.0 108.978 170.182 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.421 HG12 ' HB ' ' A' ' 5' ' ' ILE . 35.9 m -91.48 137.06 22.72 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.075 0 C-N-CA 123.178 0.591 . . . . 0.0 110.007 173.283 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -122.15 137.18 56.57 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 C-N-CA 125.776 1.63 . . . . 0.0 107.817 178.379 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 67.8 mt -95.25 137.69 22.08 Favored Pre-proline 0 CA--C 1.547 0.828 0 C-N-CA 122.756 0.423 . . . . 0.0 110.242 175.871 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.63 ' HG3' ' HB3' ' A' ' 7' ' ' ARG . 44.4 Cg_endo -85.38 -177.92 2.87 Favored 'Trans proline' 0 C--N 1.367 1.506 0 C-N-CA 123.652 2.901 . . . . 0.0 112.371 179.098 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.413 ' HD3' ' N ' ' A' ' 79' ' ' GLU . 0.1 OUTLIER -69.38 -33.52 73.17 Favored 'General case' 0 N--CA 1.482 1.138 0 N-CA-C 112.226 0.454 . . . . 0.0 112.226 -176.118 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.413 ' N ' ' HD3' ' A' ' 78' ' ' LYS . 0.3 OUTLIER -96.91 -53.09 3.64 Favored 'General case' 0 N--CA 1.484 1.249 0 C-N-CA 122.792 0.437 . . . . 0.0 110.995 -178.326 . . . . . . . . 3 3 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 C-N-CA 124.309 1.043 . . . . 0.0 112.612 -174.818 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 N--CA 1.481 1.115 0 N-CA-C 110.07 -0.345 . . . . 0.0 110.07 . . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.0 p -123.75 128.1 49.09 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 124.006 0.922 . . . . 0.0 110.129 -175.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.419 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -99.99 146.25 26.93 Favored 'General case' 0 N--CA 1.472 0.633 0 N-CA-C 109.02 -0.733 . . . . 0.0 109.02 179.839 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 10.3 ptpp? -110.09 124.93 52.38 Favored 'General case' 0 CA--C 1.54 0.587 0 N-CA-C 108.38 -0.97 . . . . 0.0 108.38 172.137 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.586 HG12 HD23 ' A' ' 25' ' ' LEU . 71.9 mt -98.41 129.76 48.22 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.686 0 N-CA-C 106.24 -1.763 . . . . 0.0 106.24 173.235 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 32.7 p90 -152.15 -179.71 7.76 Favored 'General case' 0 C--N 1.315 -0.904 0 N-CA-C 108.736 -0.838 . . . . 0.0 108.736 173.824 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.804 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 46.7 ttt180 -144.28 95.59 5.5 Favored Pre-proline 0 C--N 1.322 -0.591 0 N-CA-C 106.498 -1.668 . . . . 0.0 106.498 176.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 83.7 Cg_endo -78.29 -170.22 0.93 Allowed 'Trans proline' 0 C--N 1.366 1.477 0 C-N-CA 123.082 2.521 . . . . 0.0 112.842 -163.735 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.433 ' HA ' ' HE2' ' A' ' 78' ' ' LYS . . . -78.29 -21.26 49.99 Favored 'General case' 0 CA--C 1.545 0.773 0 C-N-CA 123.014 0.526 . . . . 0.0 110.998 173.846 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 19.1 ptmt -148.42 124.01 10.43 Favored 'General case' 0 CA--C 1.547 0.83 0 C-N-CA 124.113 0.965 . . . . 0.0 109.642 -175.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.1 p -96.24 -51.0 4.57 Favored 'General case' 0 N--CA 1.483 1.212 0 C-N-CA 123.558 0.743 . . . . 0.0 111.252 -175.977 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -145.26 102.6 3.75 Favored 'General case' 0 N--CA 1.474 0.773 0 C-N-CA 123.187 0.595 . . . . 0.0 110.274 -178.718 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 23.5 ptt? -94.99 -32.74 13.02 Favored 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 123.78 0.832 . . . . 0.0 112.227 -173.867 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -101.99 132.98 47.5 Favored 'General case' 0 N--CA 1.485 1.284 0 N-CA-C 109.018 -0.734 . . . . 0.0 109.018 -172.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 33.3 t 66.56 -80.53 0.03 OUTLIER 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 125.196 1.399 . . . . 0.0 111.493 175.555 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -81.55 77.32 2.06 Favored Glycine 0 C--N 1.348 1.247 0 N-CA-C 111.16 -0.776 . . . . 0.0 111.16 177.032 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 43.2 p -73.52 85.72 1.55 Allowed 'General case' 0 CA--C 1.544 0.75 0 C-N-CA 123.829 0.852 . . . . 0.0 110.953 -176.851 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -77.87 128.52 34.08 Favored 'General case' 0 CA--C 1.544 0.715 0 CA-C-N 115.611 -0.722 . . . . 0.0 111.0 -177.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 75.4 mmtt -82.44 -28.1 31.52 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 123.454 0.701 . . . . 0.0 110.537 175.751 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 23.3 p -77.27 95.54 4.37 Favored 'General case' 0 C--O 1.244 0.776 0 C-N-CA 123.6 0.76 . . . . 0.0 109.534 176.134 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 6.0 t30 -76.55 91.59 3.39 Favored 'General case' 0 C--N 1.346 0.446 0 N-CA-C 108.253 -1.017 . . . . 0.0 108.253 172.855 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.401 ' O ' ' HG3' ' A' ' 7' ' ' ARG . 31.5 m -98.5 -169.15 0.19 Allowed 'Isoleucine or valine' 0 CA--C 1.541 0.608 0 C-N-CA 124.986 1.315 . . . . 0.0 110.537 -177.576 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.1 m95 -86.62 136.7 32.95 Favored 'General case' 0 CA--C 1.536 0.438 0 C-N-CA 123.448 0.699 . . . . 0.0 109.153 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 92.7 t -101.61 139.42 22.82 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.553 0 CA-C-N 115.279 -0.873 . . . . 0.0 108.912 173.185 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.586 HD23 HG12 ' A' ' 5' ' ' ILE . 2.8 tm? -117.81 104.55 11.07 Favored 'General case' 0 C--N 1.343 0.326 0 N-CA-C 105.644 -1.984 . . . . 0.0 105.644 175.051 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 -107.47 134.32 50.68 Favored 'General case' 0 C--O 1.212 -0.873 0 CA-C-N 114.628 -1.169 . . . . 0.0 107.886 -176.904 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 35.4 p90 -141.52 149.97 41.56 Favored 'General case' 0 N--CA 1.471 0.58 0 C-N-CA 123.651 0.78 . . . . 0.0 109.555 176.919 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 14.6 m-20 -67.16 106.36 1.98 Allowed 'General case' 0 C--O 1.247 0.936 0 N-CA-C 108.925 -0.768 . . . . 0.0 108.925 172.476 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.429 ' HB2' HG22 ' A' ' 51' ' ' VAL . . . -61.67 118.11 6.68 Favored 'General case' 0 C--O 1.236 0.357 0 O-C-N 124.012 0.82 . . . . 0.0 109.55 178.939 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 11.0 pt-20 -84.52 39.06 0.71 Allowed 'General case' 0 N--CA 1.478 0.938 0 C-N-CA 124.174 0.989 . . . . 0.0 111.425 -176.776 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 2.5 p -53.63 131.45 55.36 Favored Pre-proline 0 CA--C 1.556 1.184 0 C-N-CA 124.174 0.99 . . . . 0.0 109.763 176.282 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.9 Cg_endo -67.6 -164.04 0.09 OUTLIER 'Trans proline' 0 C--N 1.377 2.057 0 C-N-CA 122.563 2.175 . . . . 0.0 113.084 -174.704 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 79.4 mtt180 -63.54 -27.26 69.14 Favored 'General case' 0 N--CA 1.477 0.923 0 CA-C-N 115.852 -0.613 . . . . 0.0 110.322 175.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 2.1 mptp? -82.1 88.17 6.45 Favored 'General case' 0 C--N 1.35 0.597 0 N-CA-C 107.409 -1.33 . . . . 0.0 107.409 170.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 37.9 mm -69.45 139.5 20.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.758 0 N-CA-C 109.085 -0.709 . . . . 0.0 109.085 175.927 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.0 m-20 -45.88 134.72 6.62 Favored Pre-proline 0 N--CA 1.491 1.599 0 C-N-CA 124.713 1.205 . . . . 0.0 111.779 -173.875 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 76.1 Cg_exo -46.37 -47.14 15.74 Favored 'Trans proline' 0 C--N 1.386 2.509 0 C-N-CA 123.93 3.087 . . . . 0.0 113.375 -173.673 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 84.4 mt -47.92 -43.96 11.02 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.391 0 C-N-CA 124.898 1.279 . . . . 0.0 112.223 177.887 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 22.9 ptm -118.57 21.99 12.28 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 123.759 0.823 . . . . 0.0 111.0 -175.48 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -160.4 51.36 0.36 Allowed Glycine 0 C--N 1.344 1.013 0 CA-C-N 116.699 -0.228 . . . . 0.0 113.126 -175.453 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.2 m-85 -72.2 -37.74 69.19 Favored 'General case' 0 N--CA 1.481 1.084 0 C-N-CA 122.979 0.512 . . . . 0.0 110.213 172.229 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 36.3 p -79.58 162.47 25.31 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 123.805 0.842 . . . . 0.0 111.604 -179.213 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 50.5 m -71.81 -53.75 12.34 Favored 'General case' 0 N--CA 1.475 0.777 0 C-N-CA 123.481 0.712 . . . . 0.0 109.458 175.847 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 24.1 m -80.3 77.95 7.02 Favored 'General case' 0 CA--C 1.544 0.743 0 N-CA-C 108.322 -0.992 . . . . 0.0 108.322 170.23 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 22.7 p -92.43 -179.98 5.36 Favored 'General case' 0 C--O 1.242 0.695 0 CA-C-N 115.114 -0.948 . . . . 0.0 111.123 -175.24 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 20.7 t70 -69.91 160.72 31.32 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 123.527 0.731 . . . . 0.0 111.064 -178.682 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 24.3 ptt? -71.61 -171.78 0.7 Allowed 'General case' 0 N--CA 1.482 1.145 0 C-N-CA 123.778 0.831 . . . . 0.0 111.417 -177.093 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.496 ' N ' ' HD2' ' A' ' 48' ' ' LYS . 0.2 OUTLIER -82.61 91.17 6.9 Favored 'General case' 0 C--O 1.238 0.495 0 N-CA-C 107.729 -1.212 . . . . 0.0 107.729 174.226 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 9.2 pt20 -68.54 166.09 17.76 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 114.771 -1.104 . . . . 0.0 111.048 179.872 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 3.1 pp0? -87.69 132.12 34.23 Favored 'General case' 0 N--CA 1.47 0.541 0 N-CA-C 108.995 -0.743 . . . . 0.0 108.995 166.671 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.429 HG22 ' HB2' ' A' ' 29' ' ' ALA . 33.3 m -111.36 166.64 5.67 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.545 0 C-N-CA 123.702 0.801 . . . . 0.0 109.093 169.436 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 56.6 pttt -144.87 155.88 43.7 Favored 'General case' 0 N--CA 1.477 0.886 0 CA-C-O 121.597 0.713 . . . . 0.0 112.73 -171.79 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.446 HD12 HD12 ' A' ' 25' ' ' LEU . 43.0 mt -125.39 160.4 29.48 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 125.74 1.616 . . . . 0.0 108.342 -179.323 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 15.5 p -118.84 129.41 55.2 Favored 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 123.552 0.741 . . . . 0.0 109.795 172.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 98.2 m-85 -128.15 147.31 50.55 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 125.79 1.636 . . . . 0.0 108.169 178.62 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 23.6 mt-10 -67.28 -31.36 71.62 Favored 'General case' 0 N--CA 1.484 1.228 0 C-N-CA 123.615 0.766 . . . . 0.0 111.227 -175.138 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 55.2 p -132.41 160.45 36.33 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 124.077 0.951 . . . . 0.0 110.112 -177.464 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 36.7 tt0 -60.45 -40.87 92.71 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.375 0.67 . . . . 0.0 110.481 171.544 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 -47.33 -47.21 25.82 Favored 'General case' 0 N--CA 1.484 1.243 0 O-C-N 124.497 1.123 . . . . 0.0 112.717 177.929 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 50.2 mt-30 -69.65 -31.03 68.87 Favored 'General case' 0 CA--C 1.551 1.0 0 C-N-CA 122.967 0.507 . . . . 0.0 111.761 -178.061 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.34 -42.99 34.53 Favored 'General case' 0 N--CA 1.48 1.041 0 C-N-CA 123.561 0.744 . . . . 0.0 111.599 -178.257 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.4 pt-20 -69.86 -42.68 73.18 Favored 'General case' 0 N--CA 1.477 0.881 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.894 179.225 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -60.65 -32.62 71.79 Favored 'General case' 0 N--CA 1.475 0.793 0 C-N-CA 123.23 0.612 . . . . 0.0 111.474 176.707 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 59.3 t80 -64.68 -60.01 3.6 Favored 'General case' 0 C--N 1.352 0.691 0 C-N-CA 123.228 0.611 . . . . 0.0 109.533 175.803 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.94 -50.22 69.4 Favored 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.68 1.192 . . . . 0.0 112.332 -177.052 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.7 mt-30 -59.57 -42.24 92.01 Favored 'General case' 0 N--CA 1.486 1.375 0 C-N-CA 123.976 0.91 . . . . 0.0 111.566 179.821 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -62.22 -30.57 71.18 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.646 1.178 . . . . 0.0 110.931 178.677 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 34.7 mmtp -87.88 -19.53 27.24 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.274 0.63 . . . . 0.0 111.058 176.019 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.04 -2.89 66.47 Favored Glycine 0 C--N 1.348 1.238 0 CA-C-N 116.406 -0.361 . . . . 0.0 112.845 -174.917 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 45.6 mt -67.14 108.56 1.17 Allowed 'Isoleucine or valine' 0 CA--C 1.555 1.172 0 CA-C-O 121.274 0.559 . . . . 0.0 110.537 -179.035 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.2 pt-20 -60.44 140.77 57.08 Favored 'General case' 0 N--CA 1.485 1.303 0 CA-C-N 113.735 -1.575 . . . . 0.0 108.845 171.524 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.419 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 34.5 p90 -142.31 151.63 42.16 Favored 'General case' 0 N--CA 1.478 0.972 0 CA-C-N 118.633 0.651 . . . . 0.0 112.032 -169.394 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 1.3 tmt_? -120.42 115.49 23.6 Favored 'General case' 0 N--CA 1.478 0.94 0 C-N-CA 124.247 1.019 . . . . 0.0 108.441 176.388 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 60.1 t -81.83 133.45 29.2 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.355 0 C-N-CA 123.069 0.547 . . . . 0.0 111.1 177.723 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.2 mp -116.02 136.9 51.46 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.714 0 C-N-CA 125.721 1.608 . . . . 0.0 107.477 174.136 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.5 mt -71.34 147.62 93.05 Favored Pre-proline 0 CA--C 1.546 0.801 0 C-N-CA 123.214 0.606 . . . . 0.0 110.875 179.026 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.804 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 57.8 Cg_endo -73.29 175.07 11.07 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 122.969 2.446 . . . . 0.0 113.795 -179.675 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.433 ' HE2' ' HA ' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -74.32 -22.32 59.31 Favored 'General case' 0 N--CA 1.484 1.247 0 CA-C-N 115.292 -0.867 . . . . 0.0 111.153 172.439 . . . . . . . . 3 3 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.543 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 7.0 pt-20 -96.55 5.51 50.63 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 124.282 1.033 . . . . 0.0 111.551 -175.565 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.855 0 C-N-CA 123.078 0.551 . . . . 0.0 111.064 178.942 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.8 mpt? . . . . . 0 N--CA 1.482 1.133 0 N-CA-C 109.016 -0.735 . . . . 0.0 109.016 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . 0.422 ' HA ' ' O ' ' A' ' 71' ' ' GLU . 14.6 t -121.12 128.66 52.77 Favored 'General case' 0 N--CA 1.482 1.129 0 C-N-CA 122.761 0.425 . . . . 0.0 111.257 -176.512 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.21 137.33 38.79 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.256 1.022 . . . . 0.0 110.394 179.972 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.2 OUTLIER -108.55 119.98 41.09 Favored 'General case' 0 C--O 1.238 0.5 0 C-N-CA 124.778 1.231 . . . . 0.0 108.042 175.113 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 4.0 mp -105.56 123.5 59.97 Favored 'Isoleucine or valine' 0 CA--C 1.518 -0.277 0 N-CA-C 106.313 -1.736 . . . . 0.0 106.313 175.553 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.9 p90 -156.07 172.7 17.96 Favored 'General case' 0 C--N 1.324 -0.502 0 N-CA-C 108.738 -0.838 . . . . 0.0 108.738 -177.652 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.683 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 49.9 ttt180 -136.19 96.97 12.33 Favored Pre-proline 0 N--CA 1.472 0.652 0 N-CA-C 107.89 -1.152 . . . . 0.0 107.89 175.088 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.531 ' HG2' HG23 ' A' ' 11' ' ' THR . 78.3 Cg_endo -78.5 153.54 27.09 Favored 'Trans proline' 0 C--N 1.36 1.159 0 C-N-CA 122.186 1.924 . . . . 0.0 112.217 -173.047 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -67.17 -12.98 61.48 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 123.963 0.905 . . . . 0.0 111.377 173.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.6 ptmt -117.91 110.63 17.97 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 124.067 0.947 . . . . 0.0 110.62 176.81 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.531 HG23 ' HG2' ' A' ' 8' ' ' PRO . 16.6 p -146.19 -39.26 0.22 Allowed 'General case' 0 N--CA 1.484 1.267 0 C-N-CA 125.04 1.336 . . . . 0.0 108.198 168.505 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 61.96 47.32 5.97 Favored 'General case' 0 N--CA 1.477 0.925 0 C-N-CA 124.568 1.147 . . . . 0.0 111.396 172.983 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 81.2 mmm -84.19 136.5 33.94 Favored 'General case' 0 N--CA 1.474 0.751 0 CA-C-N 115.144 -0.935 . . . . 0.0 108.703 -179.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 17.0 mm-40 -129.18 92.43 3.38 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.34 0.656 . . . . 0.0 110.203 -176.913 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . 0.401 ' OG ' HG22 ' A' ' 17' ' ' THR . 35.6 t -170.04 167.45 8.89 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 123.782 0.833 . . . . 0.0 109.655 172.274 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -75.38 -27.55 63.45 Favored Glycine 0 C--N 1.345 1.029 0 N-CA-C 111.512 -0.635 . . . . 0.0 111.512 172.924 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.401 HG22 ' OG ' ' A' ' 15' ' ' SER . 12.4 t -83.35 -19.31 36.39 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.588 0.755 . . . . 0.0 110.94 176.435 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -116.55 111.06 19.39 Favored 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.571 0.748 . . . . 0.0 110.601 -173.315 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 31.3 mmmt -62.21 143.31 56.98 Favored 'General case' 0 N--CA 1.473 0.714 0 C-N-CA 123.596 0.759 . . . . 0.0 110.126 172.019 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.1 p -52.02 -35.94 48.57 Favored 'General case' 0 N--CA 1.487 1.408 0 C-N-CA 124.118 0.967 . . . . 0.0 111.888 -176.793 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.476 ' HA ' ' OG1' ' A' ' 11' ' ' THR . 12.7 m120 -120.56 126.54 50.58 Favored 'General case' 0 C--N 1.345 0.388 0 C-N-CA 124.806 1.242 . . . . 0.0 107.88 167.253 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 9.4 p -120.51 155.56 23.75 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.162 0 C-N-CA 124.572 1.149 . . . . 0.0 108.865 -178.209 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 80.0 m95 -75.07 123.06 24.52 Favored 'General case' 0 C--N 1.361 1.073 0 N-CA-C 108.011 -1.107 . . . . 0.0 108.011 179.849 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 67.8 t -101.48 138.37 25.94 Favored 'Isoleucine or valine' 0 C--O 1.239 0.518 0 N-CA-C 108.947 -0.76 . . . . 0.0 108.947 179.33 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.522 HD23 HD12 ' A' ' 53' ' ' LEU . 52.4 tp -116.06 105.31 12.48 Favored 'General case' 0 N--CA 1.451 -0.421 0 N-CA-C 107.27 -1.382 . . . . 0.0 107.27 173.572 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.556 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 16.1 mt-10 -106.58 137.85 43.84 Favored 'General case' 0 C--N 1.317 -0.819 0 N-CA-C 106.956 -1.498 . . . . 0.0 106.956 172.12 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 37.3 p90 -143.95 154.0 42.85 Favored 'General case' 0 CA--C 1.502 -0.875 0 CA-C-N 117.571 0.169 . . . . 0.0 110.779 177.736 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 22.6 t70 -63.8 102.86 0.5 Allowed 'General case' 0 N--CA 1.452 -0.375 0 N-CA-C 107.505 -1.294 . . . . 0.0 107.505 164.792 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -55.3 123.41 13.72 Favored 'General case' 0 CA--C 1.532 0.283 0 O-C-N 123.855 0.722 . . . . 0.0 110.438 -175.473 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.8 3.08 3.48 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.039 0.936 . . . . 0.0 112.568 -175.654 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 9.7 p -88.32 132.26 39.86 Favored Pre-proline 0 CA--C 1.557 1.245 0 C-N-CA 124.155 0.982 . . . . 0.0 109.401 -179.684 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 70.7 Cg_endo -79.43 -159.32 0.1 Allowed 'Trans proline' 0 C--N 1.377 2.053 0 C-N-CA 122.907 2.405 . . . . 0.0 111.836 174.4 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 22.9 ptt180 -68.83 -14.71 63.2 Favored 'General case' 0 N--CA 1.477 0.91 0 CA-C-N 115.484 -0.78 . . . . 0.0 111.703 176.151 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.6 mmmm -75.36 87.23 2.55 Favored 'General case' 0 C--N 1.349 0.573 0 C-N-CA 123.331 0.653 . . . . 0.0 109.661 174.403 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.548 HD11 ' HA3' ' A' ' 40' ' ' GLY . 2.1 pp -124.54 -162.21 0.32 Allowed 'Isoleucine or valine' 0 CA--C 1.548 0.893 0 C-N-CA 125.019 1.328 . . . . 0.0 108.928 176.358 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 25.4 m-20 -62.28 117.6 31.85 Favored Pre-proline 0 N--CA 1.484 1.237 0 CA-C-N 118.285 0.493 . . . . 0.0 110.573 173.427 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 58.4 Cg_endo -66.64 -5.36 12.87 Favored 'Trans proline' 0 C--N 1.383 2.342 0 C-N-CA 122.947 2.431 . . . . 0.0 113.342 -174.579 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 81.3 mt -59.77 -50.12 81.25 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.828 0 C-N-CA 123.917 0.887 . . . . 0.0 110.111 168.562 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 23.8 ptt? -105.2 8.67 34.11 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.006 0.922 . . . . 0.0 111.927 -172.78 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.548 ' HA3' HD11 ' A' ' 35' ' ' ILE . . . -173.58 -152.89 9.2 Favored Glycine 0 C--N 1.344 1.02 0 CA-C-O 119.832 -0.427 . . . . 0.0 113.004 179.331 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 23.3 t80 59.27 45.28 14.36 Favored 'General case' 0 N--CA 1.484 1.239 0 C-N-CA 124.511 1.124 . . . . 0.0 110.168 -176.499 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.413 HG23 ' H ' ' A' ' 44' ' ' SER . 11.9 t -165.19 -150.43 0.13 Allowed 'General case' 0 CA--C 1.56 1.346 0 CA-C-N 114.35 -1.295 . . . . 0.0 107.91 -175.69 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.0 t -54.5 -41.76 69.97 Favored 'General case' 0 N--CA 1.487 1.383 0 CA-C-N 118.772 0.714 . . . . 0.0 110.52 171.257 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.413 ' H ' HG23 ' A' ' 42' ' ' THR . 35.6 t -70.45 107.07 3.66 Favored 'General case' 0 CA--C 1.543 0.686 0 N-CA-C 107.885 -1.154 . . . . 0.0 107.885 167.257 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 36.6 t -148.77 89.69 1.71 Allowed 'General case' 0 N--CA 1.467 0.387 0 C-N-CA 123.461 0.704 . . . . 0.0 109.157 -174.884 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 30.0 t70 -80.11 140.47 36.41 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 116.307 -0.406 . . . . 0.0 110.186 179.673 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.5 mpt? -65.06 -63.28 1.15 Allowed 'General case' 0 N--CA 1.476 0.873 0 N-CA-C 108.979 -0.749 . . . . 0.0 108.979 -178.73 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -175.11 128.67 0.29 Allowed 'General case' 0 C--O 1.241 0.611 0 N-CA-C 106.298 -1.741 . . . . 0.0 106.298 176.192 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 19.8 pt20 -89.48 -171.62 3.29 Favored 'General case' 0 N--CA 1.479 1.004 0 N-CA-C 109.739 -0.467 . . . . 0.0 109.739 179.16 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 23.8 mt-30 -127.87 96.68 4.57 Favored 'General case' 0 N--CA 1.47 0.566 0 C-N-CA 123.842 0.857 . . . . 0.0 108.906 174.295 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 21.6 m -81.47 166.08 2.47 Favored 'Isoleucine or valine' 0 C--O 1.241 0.652 0 C-N-CA 123.659 0.784 . . . . 0.0 110.755 176.844 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.556 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 3.6 ptpp? -133.21 135.77 45.25 Favored 'General case' 0 N--CA 1.468 0.447 0 CA-C-N 115.048 -0.978 . . . . 0.0 111.792 -177.114 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.522 HD12 HD23 ' A' ' 25' ' ' LEU . 42.4 mt -117.47 142.91 46.59 Favored 'General case' 0 CA--C 1.537 0.465 0 N-CA-C 107.385 -1.339 . . . . 0.0 107.385 178.749 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 24.1 p -114.68 128.95 56.59 Favored 'General case' 0 N--CA 1.474 0.761 0 N-CA-C 109.656 -0.498 . . . . 0.0 109.656 -178.059 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 93.7 m-85 -134.56 156.64 48.31 Favored 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 124.254 1.022 . . . . 0.0 110.133 -177.387 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 42.4 mm-40 -65.14 -31.3 72.42 Favored 'General case' 0 N--CA 1.48 1.071 0 O-C-N 124.001 0.813 . . . . 0.0 111.466 -179.72 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 49.6 p -135.62 164.06 28.7 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 123.412 0.685 . . . . 0.0 110.965 -175.825 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 0.8 OUTLIER -58.89 -41.73 87.85 Favored 'General case' 0 N--CA 1.475 0.816 0 CA-C-N 114.398 -1.274 . . . . 0.0 110.75 169.017 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 2.5 mm-40 -49.83 -45.74 50.54 Favored 'General case' 0 N--CA 1.484 1.27 0 O-C-N 124.922 1.389 . . . . 0.0 111.474 -174.343 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 48.2 mt-30 -72.19 -30.03 64.56 Favored 'General case' 0 CA--C 1.548 0.895 0 CA-C-N 115.016 -0.993 . . . . 0.0 112.046 -176.974 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.511 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -79.48 -40.59 29.4 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.227 0.611 . . . . 0.0 111.067 -176.912 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 20.8 pt-20 -70.78 -39.58 73.1 Favored 'General case' 0 N--CA 1.472 0.643 0 CA-C-N 115.172 -0.922 . . . . 0.0 110.936 177.031 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -55.22 -36.77 66.32 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.739 0.816 . . . . 0.0 112.5 177.125 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.7 t80 -66.59 -55.91 13.17 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.019 0.528 . . . . 0.0 110.299 178.375 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -51.79 -47.09 64.36 Favored 'General case' 0 CA--C 1.55 0.967 0 C-N-CA 124.437 1.095 . . . . 0.0 112.056 178.748 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 50.0 mt-30 -59.45 -45.24 92.18 Favored 'General case' 0 N--CA 1.483 1.203 0 C-N-CA 124.091 0.956 . . . . 0.0 111.647 178.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.5 ttt180 -54.09 -39.39 66.29 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.737 1.215 . . . . 0.0 111.309 175.316 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 33.4 mmtp -80.98 -27.0 36.1 Favored 'General case' 0 N--CA 1.474 0.769 0 C-N-CA 123.434 0.694 . . . . 0.0 111.432 -179.642 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 98.3 1.51 58.03 Favored Glycine 0 C--N 1.349 1.263 0 O-C-N 123.216 0.323 . . . . 0.0 112.592 -170.98 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 64.9 mt -69.35 107.25 1.5 Allowed 'Isoleucine or valine' 0 CA--C 1.557 1.215 0 CA-C-O 121.403 0.621 . . . . 0.0 110.201 179.185 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . 0.422 ' O ' ' HA ' ' A' ' 2' ' ' SER . 7.4 pt-20 -54.04 143.94 20.72 Favored 'General case' 0 N--CA 1.495 1.785 0 CA-C-N 113.656 -1.611 . . . . 0.0 109.018 170.826 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.8 p90 -147.36 149.25 32.43 Favored 'General case' 0 N--CA 1.482 1.158 0 CA-C-N 119.501 1.046 . . . . 0.0 113.026 -168.538 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 23.1 mmm180 -110.76 125.94 54.06 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 124.484 1.114 . . . . 0.0 109.928 171.57 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 92.4 t -89.89 118.59 35.47 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.738 0 N-CA-C 108.693 -0.854 . . . . 0.0 108.693 173.777 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 77.1 mt -122.6 117.34 51.65 Favored 'Isoleucine or valine' 0 CA--C 1.543 0.692 0 C-N-CA 125.03 1.332 . . . . 0.0 108.444 -174.45 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 80.2 mt -71.0 147.53 93.93 Favored Pre-proline 0 CA--C 1.548 0.9 0 C-N-CA 124.045 0.938 . . . . 0.0 112.239 -174.273 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.683 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 86.5 Cg_endo -79.4 -179.33 5.3 Favored 'Trans proline' 0 C--N 1.372 1.773 0 C-N-CA 123.375 2.717 . . . . 0.0 113.245 178.87 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -65.07 -31.2 72.3 Favored 'General case' 0 N--CA 1.484 1.243 0 CA-C-N 115.554 -0.748 . . . . 0.0 109.948 173.286 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 12.9 pt-20 -86.96 9.95 17.84 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 124.493 1.117 . . . . 0.0 111.696 -176.362 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.48 1.066 0 C-N-CA 122.82 0.448 . . . . 0.0 110.831 175.344 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.474 0.772 0 N-CA-C 109.526 -0.546 . . . . 0.0 109.526 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 40.8 m -133.08 165.08 25.59 Favored 'General case' 0 N--CA 1.474 0.752 0 N-CA-C 108.404 -0.962 . . . . 0.0 108.404 -168.908 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.5 155.38 24.24 Favored 'General case' 0 N--CA 1.487 1.389 0 N-CA-C 113.132 0.789 . . . . 0.0 113.132 -179.51 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 23.4 pttm -113.05 123.73 50.97 Favored 'General case' 0 CA--C 1.549 0.934 0 CA-C-N 114.722 -1.126 . . . . 0.0 108.062 162.117 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.444 HG12 ' HG ' ' A' ' 25' ' ' LEU . 89.9 mt -105.22 127.36 59.96 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.707 0 N-CA-C 106.21 -1.774 . . . . 0.0 106.21 174.926 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 25.3 p90 -148.69 176.5 10.31 Favored 'General case' 0 C--N 1.317 -0.808 0 C-N-CA 123.369 0.668 . . . . 0.0 109.434 -177.559 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.51 ' HD3' ' HB3' ' A' ' 77' ' ' PRO . 34.1 ttt180 -140.72 95.72 7.77 Favored Pre-proline 0 CA--C 1.539 0.542 0 N-CA-C 107.062 -1.458 . . . . 0.0 107.062 173.806 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.5 Cg_endo -82.05 179.52 5.51 Favored 'Trans proline' 0 C--N 1.361 1.206 0 C-N-CA 122.968 2.446 . . . . 0.0 114.607 -163.924 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -86.93 -20.97 26.57 Favored 'General case' 0 N--CA 1.472 0.67 0 CA-C-N 115.052 -0.976 . . . . 0.0 110.33 171.526 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -159.91 155.66 25.97 Favored 'General case' 0 N--CA 1.471 0.624 0 C-N-CA 124.143 0.977 . . . . 0.0 109.564 174.329 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.0 t -168.62 -160.85 0.31 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 108.041 -1.096 . . . . 0.0 108.041 -177.103 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -55.49 103.07 0.08 Allowed 'General case' 0 CA--C 1.545 0.76 0 N-CA-C 109.096 -0.705 . . . . 0.0 109.096 169.778 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.445 ' HA ' ' OG1' ' A' ' 17' ' ' THR . 67.2 mtm -68.62 93.32 0.51 Allowed 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 123.316 0.646 . . . . 0.0 110.674 -173.531 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 33.4 mm-40 -115.95 -63.04 1.51 Allowed 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 123.992 0.917 . . . . 0.0 110.077 -174.565 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 21.6 p -137.46 97.23 3.41 Favored 'General case' 0 N--CA 1.475 0.781 0 C-N-CA 123.922 0.889 . . . . 0.0 109.328 -175.237 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 73.14 -86.28 0.58 Allowed Glycine 0 C--N 1.344 1.005 0 N-CA-C 110.602 -0.999 . . . . 0.0 110.602 -171.09 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.445 ' OG1' ' HA ' ' A' ' 13' ' ' MET . 30.0 p 51.34 27.67 3.81 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 125.487 1.515 . . . . 0.0 114.381 167.261 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -151.4 -82.63 0.09 Allowed 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 123.19 0.596 . . . . 0.0 110.389 177.499 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 67.8 mttm -72.06 -60.66 2.12 Favored 'General case' 0 N--CA 1.483 1.194 0 N-CA-C 108.93 -0.767 . . . . 0.0 108.93 177.836 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 6.8 t -91.06 143.76 26.36 Favored 'General case' 0 C--O 1.235 0.299 0 N-CA-C 107.104 -1.443 . . . . 0.0 107.104 162.603 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 9.1 t-20 -147.32 161.44 40.98 Favored 'General case' 0 N--CA 1.472 0.657 0 N-CA-C 109.114 -0.699 . . . . 0.0 109.114 -176.163 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 30.5 m -110.99 176.48 1.57 Allowed 'Isoleucine or valine' 0 N--CA 1.476 0.874 0 C-N-CA 123.989 0.916 . . . . 0.0 108.764 171.293 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.4 m95 -86.64 125.93 34.17 Favored 'General case' 0 C--O 1.235 0.308 0 N-CA-C 108.928 -0.767 . . . . 0.0 108.928 -177.255 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 65.3 t -100.52 136.23 32.95 Favored 'Isoleucine or valine' 0 C--N 1.325 -0.497 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 178.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.444 ' HG ' HG12 ' A' ' 5' ' ' ILE . 5.5 tt -116.07 108.37 16.11 Favored 'General case' 0 N--CA 1.454 -0.274 0 N-CA-C 105.309 -2.108 . . . . 0.0 105.309 178.205 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 30.2 tt0 -107.05 135.0 49.35 Favored 'General case' 0 C--N 1.318 -0.801 0 N-CA-C 106.063 -1.829 . . . . 0.0 106.063 175.56 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.405 ' CE2' ' HA ' ' A' ' 29' ' ' ALA . 22.0 p90 -145.95 153.04 40.36 Favored 'General case' 0 N--CA 1.473 0.701 0 N-CA-C 113.108 0.781 . . . . 0.0 113.108 -175.025 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.5 t70 -61.45 100.83 0.15 Allowed 'General case' 0 C--O 1.242 0.706 0 O-C-N 124.412 1.07 . . . . 0.0 108.483 163.832 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.405 ' HA ' ' CE2' ' A' ' 27' ' ' PHE . . . -53.15 140.41 26.02 Favored 'General case' 0 CA--C 1.543 0.705 0 C-N-CA 124.897 1.279 . . . . 0.0 113.721 -168.931 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 22.4 pt-20 -85.99 26.67 0.97 Allowed 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 124.211 1.004 . . . . 0.0 111.517 178.77 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.5 p -65.25 122.84 82.08 Favored Pre-proline 0 CA--C 1.557 1.227 0 N-CA-C 109.353 -0.61 . . . . 0.0 109.353 178.081 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 97.5 Cg_endo -76.72 -176.59 3.23 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 122.75 2.3 . . . . 0.0 113.197 -172.967 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 11.4 ptp180 -67.19 -14.66 63.12 Favored 'General case' 0 N--CA 1.479 0.982 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.51 177.933 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 41.1 mmtm -77.29 30.41 0.14 Allowed 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 124.109 0.964 . . . . 0.0 112.388 177.626 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 26.7 pt -61.76 122.01 11.4 Favored 'Isoleucine or valine' 0 C--N 1.357 0.933 0 N-CA-C 109.405 -0.591 . . . . 0.0 109.405 169.517 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.467 ' HB3' ' O ' ' A' ' 39' ' ' MET . 16.6 t0 -67.89 127.35 93.34 Favored Pre-proline 0 CA--C 1.54 0.567 0 CA-C-N 115.321 -0.854 . . . . 0.0 109.916 -172.713 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . 0.45 ' HA ' ' HB3' ' A' ' 41' ' ' TYR . 19.0 Cg_endo -51.65 -27.11 24.89 Favored 'Trans proline' 0 C--N 1.377 2.036 0 C-N-CA 123.956 3.104 . . . . 0.0 113.055 177.943 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 19.1 mm -84.38 -53.46 10.92 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.759 0 C-N-CA 123.368 0.667 . . . . 0.0 109.466 179.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.467 ' O ' ' HB3' ' A' ' 36' ' ' ASP . 65.1 mtt -131.35 103.17 6.3 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.638 0.775 . . . . 0.0 110.223 -176.651 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 135.35 -41.85 1.4 Allowed Glycine 0 N--CA 1.471 0.978 0 N-CA-C 111.113 -0.795 . . . . 0.0 111.113 -178.26 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . 0.45 ' HB3' ' HA ' ' A' ' 37' ' ' PRO . 59.3 t80 -107.87 99.29 8.77 Favored 'General case' 0 C--O 1.239 0.526 0 N-CA-C 108.6 -0.889 . . . . 0.0 108.6 175.249 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.411 ' OG1' ' HB2' ' A' ' 45' ' ' SER . 73.9 p -132.86 166.96 21.09 Favored 'General case' 0 N--CA 1.482 1.151 0 C-N-CA 123.865 0.866 . . . . 0.0 109.675 176.917 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 28.5 t -64.67 -55.53 19.54 Favored 'General case' 0 N--CA 1.479 0.991 0 C-N-CA 123.127 0.571 . . . . 0.0 110.179 177.8 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 58.1 m -82.68 84.41 7.31 Favored 'General case' 0 CA--C 1.538 0.488 0 N-CA-C 109.027 -0.731 . . . . 0.0 109.027 173.025 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.411 ' HB2' ' OG1' ' A' ' 42' ' ' THR . 22.3 t -164.15 -177.32 4.92 Favored 'General case' 0 C--O 1.241 0.609 0 CA-C-N 114.581 -1.19 . . . . 0.0 107.849 178.075 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.6 t70 -116.1 -178.14 3.33 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.152 -0.684 . . . . 0.0 109.152 177.187 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 25.9 ttt -62.31 -43.64 98.36 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.276 0.63 . . . . 0.0 109.46 166.491 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.409 ' HD3' ' N ' ' A' ' 48' ' ' LYS . 0.0 OUTLIER -153.47 142.04 20.83 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.555 1.142 . . . . 0.0 108.948 175.989 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 27.2 pt20 -78.01 179.94 6.48 Favored 'General case' 0 N--CA 1.483 1.182 0 C-N-CA 123.616 0.767 . . . . 0.0 111.647 -179.07 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.42 ' NE2' ' H ' ' A' ' 50' ' ' GLN . 0.1 OUTLIER -128.59 90.4 3.05 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-O 122.081 0.943 . . . . 0.0 108.535 173.788 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 13.4 p -93.06 165.96 1.84 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.04 0 C-N-CA 124.307 1.043 . . . . 0.0 110.16 -174.632 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 5.3 ptpp? -135.4 140.79 45.23 Favored 'General case' 0 N--CA 1.475 0.804 0 CA-C-O 121.316 0.579 . . . . 0.0 111.833 -173.993 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 8.4 mp -120.47 153.12 37.07 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 124.988 1.315 . . . . 0.0 107.887 177.078 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 20.1 p -118.11 133.52 55.83 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 122.866 0.466 . . . . 0.0 110.634 -179.506 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 85.3 m-85 -133.84 147.18 51.17 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 125.108 1.363 . . . . 0.0 108.512 -177.5 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.484 ' HB2' HE22 ' A' ' 60' ' ' GLN . 30.7 mm-40 -71.07 -24.53 62.34 Favored 'General case' 0 N--CA 1.483 1.179 0 N-CA-C 111.963 0.357 . . . . 0.0 111.963 -172.764 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 81.1 p -136.78 163.2 31.19 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 123.647 0.779 . . . . 0.0 109.736 179.016 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 20.7 tt0 -64.51 -36.28 83.7 Favored 'General case' 0 N--CA 1.477 0.879 0 CA-C-N 116.181 -0.463 . . . . 0.0 110.757 175.043 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 47.5 mt-10 -51.0 -48.93 61.25 Favored 'General case' 0 N--CA 1.482 1.147 0 C-N-CA 123.912 0.885 . . . . 0.0 111.613 177.287 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.484 HE22 ' HB2' ' A' ' 56' ' ' GLU . 48.7 mt-30 -69.29 -29.36 67.22 Favored 'General case' 0 CA--C 1.543 0.694 0 CA-C-N 115.529 -0.76 . . . . 0.0 111.319 -176.785 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -78.4 -41.51 32.92 Favored 'General case' 0 C--N 1.353 0.747 0 C-N-CA 123.17 0.588 . . . . 0.0 110.994 177.424 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.516 ' O ' ' HG3' ' A' ' 66' ' ' GLN . 13.0 pt-20 -77.43 -44.47 28.98 Favored 'General case' 0 N--CA 1.472 0.667 0 CA-C-N 115.817 -0.629 . . . . 0.0 109.426 -169.991 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -63.65 -27.14 69.02 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 124.414 1.086 . . . . 0.0 112.16 177.278 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 88.5 t80 -64.07 -54.7 29.99 Favored 'General case' 0 N--CA 1.474 0.739 0 N-CA-C 109.095 -0.706 . . . . 0.0 109.095 172.319 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -56.5 -44.87 81.11 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 124.473 1.109 . . . . 0.0 111.944 178.774 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . 0.516 ' HG3' ' O ' ' A' ' 62' ' ' GLU . 73.1 mt-30 -60.74 -44.28 96.87 Favored 'General case' 0 N--CA 1.488 1.464 0 C-N-CA 124.105 0.962 . . . . 0.0 110.636 -179.735 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.3 ttt180 -62.26 -31.07 71.59 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 125.005 1.322 . . . . 0.0 111.01 -179.76 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.3 mmtt -87.19 -22.16 25.46 Favored 'General case' 0 CA--C 1.546 0.825 0 C-N-CA 124.051 0.94 . . . . 0.0 110.745 177.581 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 92.29 -1.31 72.96 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 116.206 -0.452 . . . . 0.0 112.704 -172.382 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 86.4 mt -60.28 109.86 0.5 Allowed 'Isoleucine or valine' 0 CA--C 1.551 1.01 0 CA-C-O 121.501 0.667 . . . . 0.0 110.357 -179.624 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.3 pt-20 -64.17 133.94 53.87 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 113.793 -1.549 . . . . 0.0 108.102 171.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 55.7 p90 -140.38 152.68 45.95 Favored 'General case' 0 N--CA 1.474 0.727 0 O-C-N 121.611 -0.681 . . . . 0.0 110.927 -171.333 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 tpt85 -118.16 116.46 26.87 Favored 'General case' 0 N--CA 1.464 0.25 0 N-CA-C 108.119 -1.067 . . . . 0.0 108.119 171.297 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 34.9 m -82.28 132.35 31.63 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.81 0 CA-C-O 121.457 0.646 . . . . 0.0 110.69 174.858 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 4.1 mp -114.4 136.15 51.91 Favored 'Isoleucine or valine' 0 C--O 1.24 0.589 0 N-CA-C 106.428 -1.693 . . . . 0.0 106.428 175.847 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 86.9 mt -63.29 152.63 84.38 Favored Pre-proline 0 CA--C 1.545 0.776 0 C-N-CA 123.339 0.656 . . . . 0.0 111.863 -178.052 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.51 ' HB3' ' HD3' ' A' ' 7' ' ' ARG . 37.2 Cg_endo -66.22 162.58 35.35 Favored 'Trans proline' 0 C--N 1.373 1.83 0 C-N-CA 122.437 2.091 . . . . 0.0 112.388 179.857 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 2.2 pttm -59.8 -30.58 69.0 Favored 'General case' 0 N--CA 1.485 1.324 0 C-N-CA 123.163 0.585 . . . . 0.0 111.248 -178.804 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER -109.96 30.78 6.39 Favored 'General case' 0 CA--C 1.542 0.654 0 C-N-CA 124.12 0.968 . . . . 0.0 110.28 -177.486 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.492 1.639 0 C-N-CA 123.327 0.651 . . . . 0.0 111.705 174.875 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.508 ' HG2' HG23 ' A' ' 70' ' ' ILE . 47.7 ttp . . . . . 0 N--CA 1.477 0.883 0 N-CA-C 108.963 -0.754 . . . . 0.0 108.963 . . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 16.0 m -121.93 126.92 49.73 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 124.136 0.974 . . . . 0.0 109.299 -177.329 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.441 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -100.93 136.95 39.96 Favored 'General case' 0 N--CA 1.471 0.622 0 C-N-CA 123.946 0.898 . . . . 0.0 109.738 -177.461 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 56.7 pttt -115.28 125.29 53.12 Favored 'General case' 0 C--O 1.24 0.559 0 N-CA-C 107.696 -1.224 . . . . 0.0 107.696 176.711 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 3.8 mp -105.37 121.82 57.95 Favored 'Isoleucine or valine' 0 C--O 1.216 -0.691 0 N-CA-C 106.289 -1.745 . . . . 0.0 106.289 179.682 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.0 p90 -147.62 172.3 14.25 Favored 'General case' 0 C--N 1.317 -0.839 0 N-CA-C 108.533 -0.914 . . . . 0.0 108.533 -177.393 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.656 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 38.7 ttt-85 -139.4 94.29 9.6 Favored Pre-proline 0 C--O 1.24 0.567 0 N-CA-C 107.458 -1.312 . . . . 0.0 107.458 177.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.618 ' HB2' ' HG2' ' A' ' 10' ' ' LYS . 68.9 Cg_endo -86.67 154.22 8.88 Favored 'Trans proline' 0 C--N 1.37 1.707 0 C-N-CA 122.866 2.378 . . . . 0.0 113.537 -168.987 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . 0.656 ' HB2' ' HG2' ' A' ' 78' ' ' LYS . . . -86.16 -13.57 46.64 Favored 'General case' 0 N--CA 1.478 0.944 0 C-N-CA 124.161 0.984 . . . . 0.0 111.354 173.266 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.618 ' HG2' ' HB2' ' A' ' 8' ' ' PRO . 16.2 ptpt -77.93 -0.79 28.93 Favored 'General case' 0 N--CA 1.485 1.296 0 C-N-CA 123.716 0.806 . . . . 0.0 111.551 179.975 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.565 HG23 ' HG2' ' A' ' 8' ' ' PRO . 18.3 p -54.64 143.66 24.16 Favored 'General case' 0 CA--C 1.548 0.892 0 C-N-CA 123.732 0.813 . . . . 0.0 111.971 175.611 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -87.79 -172.58 3.92 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 123.761 0.824 . . . . 0.0 109.931 176.817 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 55.4 mtt 59.53 25.67 14.54 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.008 0.923 . . . . 0.0 111.972 172.727 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 89.9 mt-30 -75.18 99.63 4.05 Favored 'General case' 0 CA--C 1.543 0.699 0 C-N-CA 123.148 0.579 . . . . 0.0 111.419 -174.15 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 15.7 t -105.75 -171.02 1.83 Allowed 'General case' 0 CA--C 1.55 0.951 0 C-N-CA 124.298 1.039 . . . . 0.0 109.089 174.208 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -75.56 74.4 1.52 Allowed Glycine 0 C--N 1.35 1.358 0 C-N-CA 122.65 0.166 . . . . 0.0 113.058 -179.363 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.478 HG23 HG23 ' A' ' 20' ' ' THR . 7.8 t -162.11 152.77 17.39 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 124.6 1.16 . . . . 0.0 109.227 177.625 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -80.11 -17.33 52.87 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 123.259 0.624 . . . . 0.0 110.793 178.825 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 16.9 tppt? -62.29 -23.09 66.52 Favored 'General case' 0 N--CA 1.482 1.159 0 C-N-CA 124.556 1.142 . . . . 0.0 111.931 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.478 HG23 HG23 ' A' ' 17' ' ' THR . 42.7 p -48.11 -40.88 24.86 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 125.318 1.447 . . . . 0.0 113.284 -176.899 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . 0.457 ' ND2' ' HA ' ' A' ' 9' ' ' ALA . 11.0 m120 -85.54 92.47 8.54 Favored 'General case' 0 C--O 1.224 -0.251 0 N-CA-C 107.182 -1.414 . . . . 0.0 107.182 172.983 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.9 p -88.82 151.51 3.47 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.873 0 N-CA-C 109.67 -0.493 . . . . 0.0 109.67 177.145 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.422 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 77.1 m95 -77.5 116.05 17.76 Favored 'General case' 0 C--N 1.352 0.714 0 N-CA-C 107.391 -1.337 . . . . 0.0 107.391 177.178 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.509 HG22 HG22 ' A' ' 54' ' ' THR . 40.5 t -100.48 139.59 21.53 Favored 'Isoleucine or valine' 0 C--N 1.323 -0.55 0 N-CA-C 109.292 -0.633 . . . . 0.0 109.292 -178.618 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.441 HD11 ' HB1' ' A' ' 3' ' ' ALA . 47.8 tp -116.24 106.08 13.28 Favored 'General case' 0 N--CA 1.454 -0.246 0 N-CA-C 106.874 -1.528 . . . . 0.0 106.874 -179.246 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 32.2 tt0 -114.94 133.14 56.26 Favored 'General case' 0 C--N 1.317 -0.828 0 N-CA-C 107.994 -1.113 . . . . 0.0 107.994 179.197 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 51.4 p90 -144.59 154.38 42.78 Favored 'General case' 0 CA--C 1.505 -0.752 0 C-N-CA 123.807 0.843 . . . . 0.0 109.443 179.285 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.625 ' HB2' ' HG2' ' A' ' 48' ' ' LYS . 7.7 p-10 -84.25 123.46 30.16 Favored 'General case' 0 N--CA 1.451 -0.377 0 N-CA-C 106.953 -1.499 . . . . 0.0 106.953 170.484 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -93.57 114.39 26.72 Favored 'General case' 0 N--CA 1.466 0.327 0 N-CA-C 108.139 -1.06 . . . . 0.0 108.139 -171.383 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.472 ' HG2' ' SD ' ' A' ' 1' ' ' MET . 8.4 pt-20 -75.16 64.3 1.4 Allowed 'General case' 0 CA--C 1.551 1.008 0 CA-C-O 122.223 1.011 . . . . 0.0 110.369 -178.366 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.9 p -115.4 127.0 27.17 Favored Pre-proline 0 CA--C 1.546 0.818 0 N-CA-C 108.31 -0.996 . . . . 0.0 108.31 -176.355 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 73.7 Cg_endo -72.54 175.17 10.53 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.345 2.03 . . . . 0.0 112.064 178.969 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 6.9 ptp180 -69.93 -1.31 9.24 Favored 'General case' 0 N--CA 1.482 1.147 0 CA-C-N 115.235 -0.893 . . . . 0.0 112.658 -179.198 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 75.9 mmtt -60.42 90.87 0.02 OUTLIER 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 124.47 1.108 . . . . 0.0 111.179 173.901 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 65.3 mt -78.14 145.78 9.26 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.754 0 N-CA-C 108.406 -0.961 . . . . 0.0 108.406 172.054 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 21.5 t70 -117.29 143.36 31.79 Favored Pre-proline 0 CA--C 1.544 0.733 0 CA-C-O 118.668 -0.682 . . . . 0.0 109.78 -174.154 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 8.2 Cg_endo -49.76 -23.66 8.76 Favored 'Trans proline' 0 C--N 1.382 2.293 0 C-N-CA 123.864 3.043 . . . . 0.0 114.912 175.029 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 43.3 mt -75.7 -58.12 5.1 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.248 0 N-CA-C 109.69 -0.485 . . . . 0.0 109.69 173.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 18.7 ptp -102.8 90.93 3.96 Favored 'General case' 0 CA--C 1.546 0.824 0 C-N-CA 123.561 0.745 . . . . 0.0 109.68 -175.51 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -87.18 40.49 3.08 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-N 115.654 -0.703 . . . . 0.0 114.263 -173.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 89.2 m-85 -78.7 99.47 6.64 Favored 'General case' 0 N--CA 1.47 0.572 0 C-N-CA 122.968 0.507 . . . . 0.0 110.006 -179.907 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 78.3 p -81.87 -12.14 58.6 Favored 'General case' 0 CA--C 1.552 1.047 0 CA-C-O 121.377 0.608 . . . . 0.0 110.309 169.59 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 33.3 p -72.89 -8.4 55.43 Favored 'General case' 0 CA--C 1.547 0.854 0 C-N-CA 124.564 1.146 . . . . 0.0 111.793 173.168 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 73.9 m -52.94 122.22 8.86 Favored 'General case' 0 CA--C 1.55 0.947 0 C-N-CA 123.87 0.868 . . . . 0.0 110.798 172.477 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . 0.638 ' HB3' ' SD ' ' A' ' 47' ' ' MET . 15.7 m -66.81 154.59 40.45 Favored 'General case' 0 CA--C 1.542 0.668 0 C-N-CA 124.158 0.983 . . . . 0.0 112.288 -171.792 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 10.0 m-20 -65.95 -39.47 90.48 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.455 0.702 . . . . 0.0 110.473 175.788 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . 0.638 ' SD ' ' HB3' ' A' ' 45' ' ' SER . 1.6 pmm? -83.41 167.44 17.5 Favored 'General case' 0 C--O 1.241 0.631 0 CA-C-N 115.291 -0.868 . . . . 0.0 109.349 171.062 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.625 ' HG2' ' HB2' ' A' ' 28' ' ' ASP . 0.1 OUTLIER -63.4 99.19 0.19 Allowed 'General case' 0 CA--C 1.566 1.583 0 CA-C-O 121.802 0.81 . . . . 0.0 109.551 178.526 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -58.99 127.32 31.65 Favored 'General case' 0 N--CA 1.49 1.557 0 C-N-CA 124.737 1.215 . . . . 0.0 112.758 -166.574 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.409 ' HA ' ' HA ' ' A' ' 28' ' ' ASP . 4.6 pm0 -85.69 91.64 8.35 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-O 121.727 0.775 . . . . 0.0 110.078 -177.763 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 35.9 m -89.61 163.91 2.28 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.73 0 C-N-CA 123.757 0.823 . . . . 0.0 110.079 177.385 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.0 ptmt -143.82 142.22 30.76 Favored 'General case' 0 N--CA 1.476 0.842 0 CA-C-O 121.803 0.811 . . . . 0.0 112.28 -175.531 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 6.9 mp -120.31 159.96 23.96 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 126.324 1.85 . . . . 0.0 107.281 179.55 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.509 HG22 HG22 ' A' ' 24' ' ' VAL . 25.1 p -125.76 131.38 52.52 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.718 0.407 . . . . 0.0 110.743 177.349 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 82.4 m-85 -129.44 153.61 47.77 Favored 'General case' 0 N--CA 1.476 0.872 0 C-N-CA 125.176 1.391 . . . . 0.0 109.137 -179.454 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.422 ' HB2' HE22 ' A' ' 60' ' ' GLN . 44.1 mt-10 -70.62 -25.56 63.08 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.008 0.523 . . . . 0.0 112.097 -176.185 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 71.3 p -134.15 162.56 31.79 Favored 'General case' 0 N--CA 1.477 0.912 0 CA-C-O 120.986 0.422 . . . . 0.0 111.033 179.605 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 43.1 tt0 -58.48 -44.56 89.4 Favored 'General case' 0 N--CA 1.475 0.78 0 CA-C-N 114.715 -1.13 . . . . 0.0 110.863 170.293 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.1 mt-10 -54.22 -43.64 70.98 Favored 'General case' 0 N--CA 1.472 0.626 0 O-C-N 124.652 1.22 . . . . 0.0 112.207 -177.177 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.422 HE22 ' HB2' ' A' ' 56' ' ' GLU . 48.5 mt-30 -71.07 -30.58 66.75 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.083 0.553 . . . . 0.0 111.813 -178.306 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . 0.403 ' HB1' ' HB2' ' A' ' 25' ' ' LEU . . . -80.41 -38.54 30.04 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-O 121.299 0.571 . . . . 0.0 110.859 -177.034 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -76.34 -37.36 57.43 Favored 'General case' 0 N--CA 1.468 0.435 0 CA-C-N 114.952 -1.022 . . . . 0.0 111.099 179.523 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -65.93 -32.06 73.34 Favored 'General case' 0 N--CA 1.477 0.907 0 C-N-CA 123.77 0.828 . . . . 0.0 111.722 176.512 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -65.8 -51.3 60.18 Favored 'General case' 0 N--CA 1.472 0.671 0 N-CA-C 109.27 -0.641 . . . . 0.0 109.27 175.239 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.71 -45.37 74.01 Favored 'General case' 0 CA--C 1.552 1.032 0 C-N-CA 124.383 1.073 . . . . 0.0 111.515 175.302 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.8 mt-30 -63.65 -42.94 98.06 Favored 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 124.389 1.076 . . . . 0.0 111.63 -179.826 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 31.2 ttm180 -55.77 -36.83 67.77 Favored 'General case' 0 N--CA 1.48 1.035 0 C-N-CA 124.899 1.279 . . . . 0.0 110.735 175.554 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.425 ' HB2' HG13 ' A' ' 70' ' ' ILE . 35.0 mmtp -88.62 -19.21 26.54 Favored 'General case' 0 CA--C 1.541 0.613 0 CA-C-N 115.395 -0.821 . . . . 0.0 111.458 -179.247 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 95.27 -3.33 66.33 Favored Glycine 0 C--N 1.348 1.239 0 CA-C-O 119.967 -0.352 . . . . 0.0 112.992 -176.474 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.508 HG23 ' HG2' ' A' ' 1' ' ' MET . 22.1 mt -61.61 109.58 0.57 Allowed 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 C-N-CA 123.05 0.54 . . . . 0.0 109.569 -178.936 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.05 139.06 42.55 Favored 'General case' 0 N--CA 1.48 1.072 0 CA-C-N 113.544 -1.662 . . . . 0.0 108.79 171.687 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 42.0 p90 -140.52 147.4 39.48 Favored 'General case' 0 N--CA 1.473 0.707 0 CA-C-N 119.414 1.006 . . . . 0.0 112.005 -169.346 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.5 tpp180 -122.34 136.67 54.94 Favored 'General case' 0 CA--C 1.539 0.553 0 C-N-CA 124.841 1.257 . . . . 0.0 108.439 169.101 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 22.8 m -105.69 138.23 31.85 Favored 'Isoleucine or valine' 0 CA--C 1.544 0.749 0 C-N-CA 123.131 0.572 . . . . 0.0 110.246 -179.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.7 mp -119.87 136.39 57.11 Favored 'Isoleucine or valine' 0 CA--C 1.545 0.757 0 C-N-CA 126.01 1.724 . . . . 0.0 107.029 176.871 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.467 ' HB3' ' HB2' ' A' ' 80' ' ' ALA . 85.6 mt -73.66 153.98 89.46 Favored Pre-proline 0 CA--C 1.549 0.934 0 C-N-CA 123.384 0.674 . . . . 0.0 111.345 179.91 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.656 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 30.6 Cg_endo -70.2 172.39 13.15 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 122.259 1.973 . . . . 0.0 111.984 177.525 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . 0.656 ' HG2' ' HB2' ' A' ' 9' ' ' ALA . 0.0 OUTLIER -56.51 -24.17 44.57 Favored 'General case' 0 N--CA 1.489 1.494 0 C-N-CA 124.307 1.043 . . . . 0.0 113.623 -172.924 . . . . . . . . 3 3 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 0.4 OUTLIER -109.83 -46.07 3.55 Favored 'General case' 0 N--CA 1.48 1.075 0 C-N-CA 123.086 0.554 . . . . 0.0 110.918 176.154 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.467 ' HB2' ' HB3' ' A' ' 76' ' ' LEU . . . . . . . . 0 N--CA 1.485 1.3 0 C-N-CA 125.097 1.359 . . . . 0.0 114.015 -179.489 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.635 ' HA ' ' HB2' ' A' ' 28' ' ' ASP . 45.8 mtt . . . . . 0 N--CA 1.482 1.145 0 N-CA-C 108.418 -0.956 . . . . 0.0 108.418 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.4 p -119.68 125.65 49.22 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 124.01 0.924 . . . . 0.0 110.399 -175.021 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.448 ' HB1' HD11 ' A' ' 25' ' ' LEU . . . -99.69 135.65 40.79 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.529 0.732 . . . . 0.0 109.948 -176.544 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 17.0 ptpt -108.19 126.81 53.22 Favored 'General case' 0 C--O 1.237 0.44 0 N-CA-C 107.137 -1.431 . . . . 0.0 107.137 175.371 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.511 ' HB ' HG12 ' A' ' 74' ' ' VAL . 57.0 mt -107.32 120.98 59.57 Favored 'Isoleucine or valine' 0 C--O 1.217 -0.625 0 N-CA-C 106.961 -1.496 . . . . 0.0 106.961 173.972 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.7 p90 -144.86 173.1 12.15 Favored 'General case' 0 C--N 1.314 -0.971 0 N-CA-C 108.49 -0.93 . . . . 0.0 108.49 -179.085 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.468 ' HD3' ' HB3' ' A' ' 77' ' ' PRO . 59.9 ttt180 -141.38 94.38 7.62 Favored Pre-proline 0 C--N 1.319 -0.735 0 N-CA-C 107.346 -1.353 . . . . 0.0 107.346 177.371 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_endo -91.7 161.24 3.47 Favored 'Trans proline' 0 C--N 1.364 1.369 0 C-N-CA 123.365 2.71 . . . . 0.0 113.021 -169.964 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -78.22 -30.76 48.98 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 115.788 -0.642 . . . . 0.0 110.152 172.366 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.1 ptpt -135.74 145.02 46.18 Favored 'General case' 0 N--CA 1.473 0.721 0 C-N-CA 123.875 0.87 . . . . 0.0 110.247 177.124 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 13.6 t -175.93 -170.88 0.41 Allowed 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.444 1.098 . . . . 0.0 108.439 -173.887 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.28 103.75 0.42 Allowed 'General case' 0 CA--C 1.543 0.679 0 N-CA-C 108.293 -1.003 . . . . 0.0 108.293 165.236 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 26.0 ptt? -82.89 39.39 0.63 Allowed 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 124.298 1.039 . . . . 0.0 111.695 -173.439 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 11.1 pt20 -123.33 164.41 18.86 Favored 'General case' 0 C--O 1.245 0.834 0 C-N-CA 124.845 1.258 . . . . 0.0 108.962 176.871 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 27.7 m 69.38 -69.28 0.17 Allowed 'General case' 0 CA--C 1.549 0.904 0 C-N-CA 125.152 1.381 . . . . 0.0 110.487 -176.848 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -87.71 66.04 3.45 Favored Glycine 0 C--N 1.346 1.085 0 CA-C-N 116.638 -0.256 . . . . 0.0 112.881 176.077 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 31.0 p -92.2 54.27 2.32 Favored 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.628 0.771 . . . . 0.0 110.021 177.571 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -82.96 168.82 16.65 Favored 'General case' 0 N--CA 1.473 0.703 0 CA-C-N 115.346 -0.843 . . . . 0.0 110.516 -179.481 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 35.5 mtmm -61.77 -42.1 98.55 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.246 0.618 . . . . 0.0 110.519 -178.969 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 31.6 p -100.78 167.08 10.53 Favored 'General case' 0 CA--C 1.542 0.656 0 C-N-CA 124.128 0.971 . . . . 0.0 110.083 173.637 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 17.1 m120 -66.04 139.04 58.17 Favored 'General case' 0 N--CA 1.474 0.765 0 N-CA-C 108.681 -0.859 . . . . 0.0 108.681 168.404 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.403 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 20.9 m -113.1 175.18 2.2 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.102 0 C-N-CA 123.334 0.654 . . . . 0.0 110.351 -178.82 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 81.5 m95 -85.15 121.71 28.29 Favored 'General case' 0 CA--C 1.537 0.453 0 N-CA-C 108.735 -0.839 . . . . 0.0 108.735 -177.433 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.507 HG22 HG22 ' A' ' 54' ' ' THR . 53.1 t -100.21 136.53 31.18 Favored 'Isoleucine or valine' 0 C--O 1.24 0.592 0 N-CA-C 108.36 -0.978 . . . . 0.0 108.36 179.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.448 HD11 ' HB1' ' A' ' 3' ' ' ALA . 56.2 tp -116.77 106.28 13.31 Favored 'General case' 0 CA--C 1.532 0.251 0 C-N-CA 124.878 1.271 . . . . 0.0 108.336 -178.327 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 44.5 tt0 -112.38 133.7 54.33 Favored 'General case' 0 N--CA 1.477 0.888 0 N-CA-C 108.521 -0.918 . . . . 0.0 108.521 179.568 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.439 ' CE2' ' HA ' ' A' ' 29' ' ' ALA . 12.4 p90 -145.85 155.98 43.26 Favored 'General case' 0 N--CA 1.474 0.739 0 CA-C-N 118.372 0.533 . . . . 0.0 110.87 -177.34 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.635 ' HB2' ' HA ' ' A' ' 1' ' ' MET . 3.6 m-20 -61.52 97.94 0.08 Allowed 'General case' 0 C--O 1.241 0.623 0 N-CA-C 107.488 -1.301 . . . . 0.0 107.488 167.343 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.469 ' HB2' HG22 ' A' ' 51' ' ' VAL . . . -67.81 139.91 56.61 Favored 'General case' 0 N--CA 1.474 0.732 0 O-C-N 123.882 0.738 . . . . 0.0 110.749 -171.083 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.5 pt-20 -75.09 64.39 1.38 Allowed 'General case' 0 N--CA 1.478 0.97 0 CA-C-O 122.234 1.016 . . . . 0.0 110.64 -179.148 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 8.0 p -147.85 119.26 4.49 Favored Pre-proline 0 CA--C 1.549 0.918 0 N-CA-C 107.984 -1.117 . . . . 0.0 107.984 -176.381 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.402 ' O ' HG23 ' A' ' 35' ' ' ILE . 83.4 Cg_endo -77.83 -156.03 0.06 OUTLIER 'Trans proline' 0 C--N 1.373 1.828 0 C-N-CA 122.639 2.226 . . . . 0.0 111.438 -178.829 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -55.73 -21.77 20.42 Favored 'General case' 0 CA--C 1.554 1.111 0 C-N-CA 123.322 0.649 . . . . 0.0 112.048 172.312 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 28.6 tptp -77.88 72.4 4.41 Favored 'General case' 0 CA--C 1.543 0.698 0 C-N-CA 123.919 0.888 . . . . 0.0 108.917 173.26 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.402 HG23 ' O ' ' A' ' 32' ' ' PRO . 2.6 pp -96.03 -171.57 0.22 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.825 0 C-N-CA 123.747 0.819 . . . . 0.0 109.979 177.837 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.0 m-20 -60.1 122.01 63.23 Favored Pre-proline 0 CA--C 1.555 1.14 0 C-N-CA 123.342 0.657 . . . . 0.0 111.502 -179.484 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.5 Cg_endo -66.58 -10.13 26.79 Favored 'Trans proline' 0 C--N 1.382 2.326 0 C-N-CA 122.806 2.337 . . . . 0.0 112.774 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 50.0 mm -56.42 -42.91 76.27 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.804 0 C-N-CA 124.472 1.109 . . . . 0.0 110.163 172.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 53.8 mtm -120.66 28.11 8.15 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 124.283 1.033 . . . . 0.0 109.744 -179.849 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -85.94 -2.21 86.39 Favored Glycine 0 C--N 1.347 1.152 0 N-CA-C 114.968 0.747 . . . . 0.0 114.968 -171.661 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 56.2 t80 -72.91 83.02 1.21 Allowed 'General case' 0 N--CA 1.478 0.929 0 CA-C-N 117.69 0.745 . . . . 0.0 110.062 179.121 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 3.6 t -173.24 115.73 0.26 Allowed 'General case' 0 CA--C 1.541 0.626 0 C-N-CA 124.688 1.195 . . . . 0.0 108.097 -179.151 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 25.1 m -59.38 -47.71 84.39 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 123.229 0.612 . . . . 0.0 111.345 -175.621 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 42.7 t -100.47 97.59 8.3 Favored 'General case' 0 CA--C 1.54 0.585 0 N-CA-C 108.242 -1.022 . . . . 0.0 108.242 169.666 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 24.8 m -82.98 -178.74 7.23 Favored 'General case' 0 CA--C 1.549 0.914 0 C-N-CA 123.672 0.789 . . . . 0.0 110.741 178.588 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 28.9 m-20 -66.35 131.52 46.27 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 122.924 0.49 . . . . 0.0 110.078 175.003 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.8 mpt? -61.57 -38.12 86.34 Favored 'General case' 0 N--CA 1.482 1.132 0 N-CA-C 109.557 -0.534 . . . . 0.0 109.557 170.16 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -156.58 132.55 9.7 Favored 'General case' 0 C--O 1.241 0.637 0 N-CA-C 107.791 -1.189 . . . . 0.0 107.791 169.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.0 pt20 -96.99 116.11 28.63 Favored 'General case' 0 N--CA 1.477 0.918 0 N-CA-C 109.208 -0.664 . . . . 0.0 109.208 175.767 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.406 ' HA ' ' O ' ' A' ' 27' ' ' PHE . 2.2 mp0 -71.32 91.33 0.98 Allowed 'General case' 0 N--CA 1.475 0.82 0 N-CA-C 109.229 -0.656 . . . . 0.0 109.229 178.272 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.469 HG22 ' HB2' ' A' ' 29' ' ' ALA . 22.2 m -88.85 168.52 1.53 Allowed 'Isoleucine or valine' 0 N--CA 1.471 0.607 0 C-N-CA 124.152 0.981 . . . . 0.0 109.879 -179.97 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -137.55 147.69 45.34 Favored 'General case' 0 N--CA 1.469 0.505 0 CA-C-O 121.927 0.87 . . . . 0.0 112.309 -175.642 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 1.6 mm? -118.94 156.69 29.11 Favored 'General case' 0 N--CA 1.469 0.506 0 CA-C-N 113.721 -1.581 . . . . 0.0 107.136 176.591 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.507 HG22 HG22 ' A' ' 24' ' ' VAL . 12.2 p -122.76 128.6 50.69 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 118.419 0.554 . . . . 0.0 110.372 176.31 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.403 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 97.9 m-85 -128.62 152.15 48.67 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 125.379 1.472 . . . . 0.0 108.534 -178.248 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.408 ' HB2' HE22 ' A' ' 60' ' ' GLN . 49.1 mm-40 -65.96 -33.63 76.27 Favored 'General case' 0 N--CA 1.484 1.241 0 CA-C-O 120.888 0.375 . . . . 0.0 111.302 -179.091 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 65.1 p -134.33 159.32 41.37 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.52 0.728 . . . . 0.0 110.694 -173.686 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 32.0 tt0 -58.45 -44.84 89.35 Favored 'General case' 0 N--CA 1.481 1.107 0 C-N-CA 124.54 1.136 . . . . 0.0 111.419 174.243 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.6 mp0 -50.36 -43.11 54.06 Favored 'General case' 0 N--CA 1.477 0.903 0 C-N-CA 125.006 1.322 . . . . 0.0 112.798 178.416 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.408 HE22 ' HB2' ' A' ' 56' ' ' GLU . 49.2 mt-30 -70.99 -31.68 68.29 Favored 'General case' 0 N--CA 1.479 0.982 0 C-N-CA 123.013 0.525 . . . . 0.0 111.964 179.751 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.53 -40.31 57.16 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 122.78 0.432 . . . . 0.0 111.088 -179.998 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 14.1 pt-20 -72.45 -33.87 67.35 Favored 'General case' 0 N--CA 1.472 0.647 0 CA-C-N 115.413 -0.812 . . . . 0.0 110.773 177.632 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -56.2 -41.25 75.29 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.08 0.552 . . . . 0.0 111.427 173.763 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 66.9 t80 -67.08 -58.79 4.22 Favored 'General case' 0 C--N 1.347 0.495 0 C-N-CA 123.314 0.645 . . . . 0.0 110.387 179.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -50.85 -51.48 50.95 Favored 'General case' 0 CA--C 1.554 1.115 0 C-N-CA 124.79 1.236 . . . . 0.0 112.744 178.743 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 45.6 mt-30 -63.6 -40.02 95.86 Favored 'General case' 0 N--CA 1.486 1.349 0 C-N-CA 123.698 0.799 . . . . 0.0 111.816 -177.793 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 69.3 ttt180 -54.45 -37.15 64.85 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 124.615 1.166 . . . . 0.0 110.855 174.289 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.548 ' HB2' HG13 ' A' ' 70' ' ' ILE . 33.0 mmtp -90.43 -20.06 23.19 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 123.497 0.719 . . . . 0.0 111.686 -178.441 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 96.57 1.86 60.28 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-O 119.891 -0.394 . . . . 0.0 113.14 -176.406 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.548 HG13 ' HB2' ' A' ' 68' ' ' LYS . 10.7 mt -64.25 108.71 0.73 Allowed 'Isoleucine or valine' 0 N--CA 1.483 1.196 0 CA-C-O 120.956 0.408 . . . . 0.0 110.439 -178.975 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 3.7 pm0 -56.43 139.2 49.78 Favored 'General case' 0 N--CA 1.488 1.436 0 CA-C-N 114.231 -1.349 . . . . 0.0 109.152 171.428 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 27.7 p90 -148.14 153.09 38.37 Favored 'General case' 0 N--CA 1.473 0.692 0 CA-C-N 118.794 0.724 . . . . 0.0 111.179 -170.408 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . 0.43 ' NH1' HG13 ' A' ' 75' ' ' ILE . 6.2 tmm_? -133.92 146.81 50.86 Favored 'General case' 0 CA--C 1.544 0.734 0 N-CA-C 108.313 -0.995 . . . . 0.0 108.313 169.539 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.511 HG12 ' HB ' ' A' ' 5' ' ' ILE . 19.8 m -106.36 140.91 22.94 Favored 'Isoleucine or valine' 0 CA--C 1.547 0.849 0 CA-C-O 121.746 0.784 . . . . 0.0 111.747 -173.834 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.43 HG13 ' NH1' ' A' ' 73' ' ' ARG . 3.3 mp -109.35 141.5 24.47 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.818 0 C-N-CA 125.803 1.641 . . . . 0.0 107.088 173.517 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.6 mt -65.42 151.21 94.72 Favored Pre-proline 0 CA--C 1.552 1.042 0 C-N-CA 122.761 0.424 . . . . 0.0 111.531 179.171 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.468 ' HB3' ' HD3' ' A' ' 7' ' ' ARG . 40.6 Cg_endo -67.34 169.78 14.77 Favored 'Trans proline' 0 C--N 1.375 1.93 0 C-N-CA 122.662 2.242 . . . . 0.0 114.049 -179.897 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -70.09 -20.63 63.19 Favored 'General case' 0 N--CA 1.48 1.033 0 CA-C-N 115.109 -0.95 . . . . 0.0 111.361 175.7 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.447 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 1.0 OUTLIER -100.49 8.95 43.21 Favored 'General case' 0 CA--C 1.543 0.709 0 C-N-CA 124.276 1.03 . . . . 0.0 111.683 179.981 . . . . . . . . 3 3 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.478 0.943 0 C-N-CA 123.419 0.688 . . . . 0.0 109.628 173.714 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 76.5 mtm . . . . . 0 N--CA 1.484 1.227 0 N-CA-C 109.823 -0.436 . . . . 0.0 109.823 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 14.0 p -135.61 106.79 6.75 Favored 'General case' 0 N--CA 1.475 0.786 0 N-CA-C 107.907 -1.145 . . . . 0.0 107.907 -176.647 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.63 137.12 39.46 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 122.909 0.484 . . . . 0.0 111.189 -166.112 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 18.7 ptpt -109.85 132.11 54.45 Favored 'General case' 0 C--O 1.24 0.587 0 N-CA-C 108.205 -1.035 . . . . 0.0 108.205 174.827 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.472 HG21 ' HG3' ' A' ' 58' ' ' GLN . 40.2 mt -112.57 123.98 68.79 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.689 0 N-CA-C 108.607 -0.886 . . . . 0.0 108.607 176.667 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 26.3 p90 -150.45 175.29 12.0 Favored 'General case' 0 C--N 1.317 -0.848 0 N-CA-C 109.1 -0.704 . . . . 0.0 109.1 -178.86 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.77 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 40.7 ttt-85 -136.74 97.17 11.45 Favored Pre-proline 0 N--CA 1.479 0.992 0 N-CA-C 108.181 -1.044 . . . . 0.0 108.181 174.258 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 94.0 Cg_endo -78.68 167.65 22.19 Favored 'Trans proline' 0 C--N 1.371 1.717 0 C-N-CA 123.253 2.635 . . . . 0.0 112.638 -170.745 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -71.11 -36.32 72.1 Favored 'General case' 0 N--CA 1.477 0.895 0 C-N-CA 123.255 0.622 . . . . 0.0 110.658 178.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -116.84 121.33 41.21 Favored 'General case' 0 N--CA 1.467 0.404 0 N-CA-C 108.572 -0.899 . . . . 0.0 108.572 171.307 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 23.8 m -123.04 123.03 39.95 Favored 'General case' 0 CA--C 1.54 0.575 0 C-N-CA 124.747 1.219 . . . . 0.0 109.358 -174.567 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -79.14 148.79 32.22 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.712 0.405 . . . . 0.0 110.316 177.357 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -92.02 121.14 33.31 Favored 'General case' 0 N--CA 1.476 0.839 0 N-CA-C 109.78 -0.452 . . . . 0.0 109.78 179.368 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 6.6 tp-100 -81.75 -34.43 30.45 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.065 0.546 . . . . 0.0 110.126 178.864 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.0 t -153.5 57.07 0.76 Allowed 'General case' 0 N--CA 1.478 0.938 0 CA-C-O 121.496 0.665 . . . . 0.0 109.25 177.573 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 64.81 33.94 88.57 Favored Glycine 0 C--N 1.349 1.3 0 CA-C-N 115.402 -0.817 . . . . 0.0 111.909 -175.344 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 26.0 p -104.4 21.79 16.05 Favored 'General case' 0 CA--C 1.545 0.785 0 C-N-CA 124.428 1.091 . . . . 0.0 112.734 -168.411 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -140.87 88.4 2.18 Favored 'General case' 0 N--CA 1.477 0.898 0 CA-C-O 120.745 0.307 . . . . 0.0 110.722 -179.85 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 17.3 ptpt -81.73 -41.02 21.86 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.339 0.656 . . . . 0.0 109.592 172.044 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 25.5 p -134.21 -80.42 0.46 Allowed 'General case' 0 CA--C 1.543 0.69 0 C-N-CA 124.309 1.043 . . . . 0.0 108.399 174.796 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -146.14 131.51 18.6 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.968 0.907 . . . . 0.0 109.323 179.27 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.445 ' HB ' ' O ' ' A' ' 55' ' ' PHE . 16.8 m -122.66 176.47 4.67 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.946 0 N-CA-C 108.311 -0.996 . . . . 0.0 108.311 166.79 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 60.9 m95 -86.94 130.32 34.51 Favored 'General case' 0 CA--C 1.538 0.483 0 N-CA-C 108.356 -0.979 . . . . 0.0 108.356 -177.11 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 64.1 t -101.29 137.54 28.57 Favored 'Isoleucine or valine' 0 C--O 1.239 0.54 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 179.681 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 54.2 tp -115.27 105.09 12.47 Favored 'General case' 0 C--N 1.342 0.255 0 N-CA-C 107.16 -1.422 . . . . 0.0 107.16 177.377 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -118.58 130.17 55.74 Favored 'General case' 0 N--CA 1.474 0.75 0 N-CA-C 108.551 -0.907 . . . . 0.0 108.551 -175.441 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.2 p90 -138.59 155.34 48.42 Favored 'General case' 0 N--CA 1.475 0.786 0 CA-C-N 118.401 0.546 . . . . 0.0 111.561 -173.875 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -65.34 94.89 0.18 Allowed 'General case' 0 C--O 1.237 0.438 0 O-C-N 124.092 0.87 . . . . 0.0 109.868 168.892 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.563 ' HB3' ' HG3' ' A' ' 49' ' ' GLN . . . -74.92 99.99 3.98 Favored 'General case' 0 C--O 1.245 0.831 0 CA-C-N 115.106 -0.952 . . . . 0.0 109.196 179.431 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.514 ' HA ' ' HG3' ' A' ' 48' ' ' LYS . 10.0 pt-20 -67.77 96.28 0.56 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 115.125 -0.943 . . . . 0.0 110.722 -178.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 4.5 p -111.19 99.49 43.61 Favored Pre-proline 0 CA--C 1.554 1.114 0 CA-C-N 115.364 -0.834 . . . . 0.0 109.178 175.57 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 55.0 Cg_endo -83.32 -144.13 0.03 OUTLIER 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 123.133 2.555 . . . . 0.0 110.563 171.946 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -56.74 -4.14 0.15 Allowed 'General case' 0 N--CA 1.489 1.475 0 N-CA-C 113.754 1.02 . . . . 0.0 113.754 172.361 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 12.6 mmmm -59.38 -6.9 1.12 Allowed 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.21 1.004 . . . . 0.0 113.649 174.132 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.414 HD12 ' O ' ' A' ' 35' ' ' ILE . 1.9 pp -54.95 98.55 0.03 OUTLIER 'Isoleucine or valine' 0 CA--C 1.554 1.127 0 CA-C-O 121.564 0.697 . . . . 0.0 109.367 165.674 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 6.4 m-20 -56.1 133.91 74.56 Favored Pre-proline 0 N--CA 1.476 0.845 0 CA-C-N 115.024 -0.989 . . . . 0.0 111.775 -170.343 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 14.7 Cg_endo -57.13 -14.81 15.93 Favored 'Trans proline' 0 C--N 1.382 2.311 0 C-N-CA 123.142 2.561 . . . . 0.0 112.936 172.773 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 41.4 mm -60.39 -39.76 82.0 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.005 0 C-N-CA 124.086 0.954 . . . . 0.0 110.246 171.412 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 78.7 mtp -113.88 97.14 6.21 Favored 'General case' 0 N--CA 1.479 1.025 0 C-N-CA 124.149 0.979 . . . . 0.0 109.136 173.838 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -61.66 99.8 0.24 Allowed Glycine 0 C--N 1.348 1.246 0 O-C-N 123.352 0.408 . . . . 0.0 113.019 -179.584 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 42.7 t80 -128.86 15.01 6.39 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 123.842 0.857 . . . . 0.0 110.07 -178.121 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 34.4 p -69.95 -8.76 51.55 Favored 'General case' 0 CA--C 1.55 0.964 0 C-N-CA 123.76 0.824 . . . . 0.0 112.961 -175.762 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.0 m -71.47 -18.3 62.31 Favored 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.612 0.765 . . . . 0.0 111.867 175.005 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 54.8 m -143.66 104.59 4.22 Favored 'General case' 0 C--N 1.355 0.809 0 C-N-CA 123.387 0.675 . . . . 0.0 110.554 177.941 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 34.6 t -94.37 88.29 5.48 Favored 'General case' 0 N--CA 1.476 0.827 0 N-CA-C 108.283 -1.006 . . . . 0.0 108.283 171.803 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.2 m-20 -81.0 145.55 31.12 Favored 'General case' 0 C--O 1.243 0.743 0 CA-C-N 115.417 -0.811 . . . . 0.0 110.455 -179.797 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.1 mpt? -73.77 89.84 1.83 Allowed 'General case' 0 C--O 1.246 0.875 0 CA-C-N 115.995 -0.548 . . . . 0.0 109.651 179.294 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.514 ' HG3' ' HA ' ' A' ' 30' ' ' GLU . 0.0 OUTLIER 61.38 -170.57 0.16 Allowed 'General case' 0 CA--C 1.551 0.987 0 C-N-CA 124.93 1.292 . . . . 0.0 111.797 177.143 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . 0.563 ' HG3' ' HB3' ' A' ' 29' ' ' ALA . 12.7 pt20 -151.39 -170.57 3.69 Favored 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 124.174 0.99 . . . . 0.0 108.335 173.765 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 4.8 pm0 -140.06 113.99 8.88 Favored 'General case' 0 N--CA 1.471 0.602 0 N-CA-C 109.185 -0.672 . . . . 0.0 109.185 173.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.414 HG22 ' HB2' ' A' ' 29' ' ' ALA . 29.8 m -108.66 166.49 4.46 Favored 'Isoleucine or valine' 0 C--O 1.241 0.625 0 C-N-CA 124.016 0.927 . . . . 0.0 109.491 172.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -144.61 150.48 37.5 Favored 'General case' 0 CA--C 1.539 0.545 0 CA-C-O 122.336 1.065 . . . . 0.0 113.361 -173.056 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.9 mp -121.68 159.15 27.14 Favored 'General case' 0 N--CA 1.47 0.56 0 CA-C-N 113.532 -1.667 . . . . 0.0 107.599 -179.989 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 9.7 p -122.28 129.87 52.61 Favored 'General case' 0 CA--C 1.541 0.614 0 C-N-CA 124.081 0.953 . . . . 0.0 110.309 175.924 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.462 ' HB3' ' HB2' ' A' ' 60' ' ' GLN . 94.9 m-85 -130.54 148.93 52.4 Favored 'General case' 0 N--CA 1.473 0.698 0 C-N-CA 125.268 1.427 . . . . 0.0 108.171 178.955 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.99 -29.65 70.07 Favored 'General case' 0 N--CA 1.487 1.379 0 CA-C-O 120.906 0.384 . . . . 0.0 110.477 -176.066 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 64.8 p -133.07 159.66 39.44 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 124.2 1.0 . . . . 0.0 110.134 -176.379 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.472 ' HG3' HG21 ' A' ' 5' ' ' ILE . 41.0 tt0 -59.99 -41.17 91.45 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.7 0.8 . . . . 0.0 110.864 171.871 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 45.2 mt-10 -50.48 -45.57 56.37 Favored 'General case' 0 N--CA 1.473 0.688 0 O-C-N 124.559 1.162 . . . . 0.0 112.201 -177.929 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.462 ' HB2' ' HB3' ' A' ' 55' ' ' PHE . 48.8 mt-30 -67.32 -32.54 73.57 Favored 'General case' 0 CA--C 1.552 1.039 0 C-N-CA 123.178 0.591 . . . . 0.0 111.385 -178.571 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.18 -42.95 54.73 Favored 'General case' 0 N--CA 1.483 1.215 0 C-N-CA 123.058 0.543 . . . . 0.0 111.459 179.877 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 15.4 pt-20 -75.08 -39.22 60.94 Favored 'General case' 0 N--CA 1.472 0.634 0 CA-C-N 115.366 -0.834 . . . . 0.0 111.844 -176.818 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -61.9 -31.29 71.57 Favored 'General case' 0 N--CA 1.473 0.697 0 C-N-CA 123.518 0.727 . . . . 0.0 111.661 177.258 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . 0.507 ' O ' ' HG2' ' A' ' 68' ' ' LYS . 14.9 t80 -66.91 -56.64 9.39 Favored 'General case' 0 CA--C 1.542 0.668 0 N-CA-C 109.262 -0.644 . . . . 0.0 109.262 173.942 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.83 -45.66 70.92 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 124.086 0.954 . . . . 0.0 112.529 -179.523 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 49.2 mt-30 -62.03 -43.93 97.8 Favored 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 124.487 1.115 . . . . 0.0 110.924 179.994 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 29.7 ttm180 -57.23 -34.52 68.65 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 124.703 1.201 . . . . 0.0 111.646 176.972 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.63 ' HB2' HG13 ' A' ' 70' ' ' ILE . 11.7 mmmm -92.22 -16.88 25.61 Favored 'General case' 0 N--CA 1.474 0.748 0 CA-C-N 115.874 -0.603 . . . . 0.0 111.13 -176.683 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 88.48 1.5 80.85 Favored Glycine 0 C--N 1.35 1.35 0 O-C-N 123.616 0.573 . . . . 0.0 112.849 -173.533 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.63 HG13 ' HB2' ' A' ' 68' ' ' LYS . 73.0 mt -57.95 114.94 0.82 Allowed 'Isoleucine or valine' 0 N--CA 1.478 0.958 0 C-N-CA 123.259 0.623 . . . . 0.0 110.988 -179.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.2 pt-20 -57.61 131.2 49.51 Favored 'General case' 0 N--CA 1.48 1.06 0 CA-C-N 113.942 -1.481 . . . . 0.0 108.543 169.692 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.7 p90 -144.01 147.97 34.61 Favored 'General case' 0 C--N 1.345 0.408 0 CA-C-O 121.272 0.558 . . . . 0.0 111.43 -175.967 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 25.0 mmt180 -117.6 123.06 45.26 Favored 'General case' 0 N--CA 1.463 0.178 0 CA-C-N 115.067 -0.969 . . . . 0.0 109.343 172.225 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 86.9 t -80.19 124.2 37.9 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.459 0 N-CA-C 109.013 -0.736 . . . . 0.0 109.013 170.309 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.6 mp -107.87 120.44 59.23 Favored 'Isoleucine or valine' 0 C--O 1.242 0.674 0 N-CA-C 105.472 -2.048 . . . . 0.0 105.472 169.417 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 47.3 mt -58.8 149.36 64.59 Favored Pre-proline 0 CA--C 1.544 0.748 0 O-C-N 123.185 0.303 . . . . 0.0 110.28 176.662 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.77 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 40.7 Cg_endo -65.51 163.25 30.59 Favored 'Trans proline' 0 C--N 1.363 1.306 0 C-N-CA 122.252 1.968 . . . . 0.0 112.233 -177.945 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -56.31 -30.47 62.6 Favored 'General case' 0 N--CA 1.482 1.158 0 C-N-CA 124.078 0.951 . . . . 0.0 111.306 178.203 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.43 ' HG2' ' HB2' ' A' ' 77' ' ' PRO . 6.8 pt-20 -76.76 -24.22 52.95 Favored 'General case' 0 CA--C 1.546 0.804 0 C-N-CA 124.402 1.081 . . . . 0.0 111.462 -175.313 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.479 0.995 0 C-N-CA 123.517 0.727 . . . . 0.0 112.329 -175.555 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.487 1.393 0 N-CA-C 108.64 -0.874 . . . . 0.0 108.64 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 48.3 m -116.62 116.9 28.44 Favored 'General case' 0 N--CA 1.473 0.69 0 N-CA-C 109.299 -0.63 . . . . 0.0 109.299 -171.142 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.456 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -100.89 123.79 45.61 Favored 'General case' 0 C--O 1.218 -0.589 0 C-N-CA 123.146 0.578 . . . . 0.0 109.899 -172.069 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 61.5 pttt -107.18 119.26 38.91 Favored 'General case' 0 C--O 1.238 0.466 0 N-CA-C 107.411 -1.329 . . . . 0.0 107.411 179.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 91.5 mt -105.09 121.19 56.77 Favored 'Isoleucine or valine' 0 C--O 1.22 -0.497 0 N-CA-C 107.547 -1.279 . . . . 0.0 107.547 -177.213 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.439 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 22.7 p90 -152.15 177.49 10.47 Favored 'General case' 0 C--N 1.319 -0.759 0 N-CA-C 108.799 -0.815 . . . . 0.0 108.799 -176.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.534 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 21.7 ttt180 -143.52 97.5 5.52 Favored Pre-proline 0 C--N 1.319 -0.744 0 N-CA-C 108.148 -1.056 . . . . 0.0 108.148 -178.623 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 21.2 Cg_exo -64.71 132.55 33.2 Favored 'Trans proline' 0 C--N 1.371 1.745 0 C-N-CA 122.675 2.25 . . . . 0.0 112.085 -174.913 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -61.53 -33.86 74.54 Favored 'General case' 0 N--CA 1.476 0.847 0 C-N-CA 123.649 0.779 . . . . 0.0 110.525 173.616 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 18.5 ptmt -152.13 149.31 28.65 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 107.953 -1.129 . . . . 0.0 107.953 171.69 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 7.8 t -156.18 176.25 12.91 Favored 'General case' 0 CA--C 1.544 0.727 0 C-N-CA 122.846 0.458 . . . . 0.0 111.001 -169.643 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -91.13 -0.02 57.62 Favored 'General case' 0 N--CA 1.479 0.984 0 C-N-CA 123.866 0.866 . . . . 0.0 111.56 177.014 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 22.1 mmt -65.18 94.31 0.15 Allowed 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 123.274 0.63 . . . . 0.0 110.324 178.232 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 66.7 mt-30 -77.01 102.42 6.44 Favored 'General case' 0 N--CA 1.472 0.647 0 N-CA-C 109.439 -0.578 . . . . 0.0 109.439 177.634 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 10.8 t -158.5 -174.2 4.67 Favored 'General case' 0 CA--C 1.545 0.782 0 C-N-CA 123.346 0.658 . . . . 0.0 109.903 -171.811 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -85.35 35.36 3.17 Favored Glycine 0 C--N 1.351 1.402 0 CA-C-N 116.811 -0.177 . . . . 0.0 113.177 177.807 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 34.4 p -88.86 78.28 7.61 Favored 'General case' 0 CA--C 1.545 0.772 0 C-N-CA 123.512 0.725 . . . . 0.0 109.899 178.443 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -91.78 122.3 34.19 Favored 'General case' 0 N--CA 1.474 0.758 0 CA-C-N 115.449 -0.796 . . . . 0.0 109.742 178.47 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 88.1 tttt 68.42 -72.9 0.09 Allowed 'General case' 0 N--CA 1.478 0.956 0 C-N-CA 125.18 1.392 . . . . 0.0 111.185 178.846 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 33.4 p -75.02 129.86 38.34 Favored 'General case' 0 CA--C 1.537 0.478 0 C-N-CA 122.856 0.462 . . . . 0.0 110.466 177.644 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 11.4 m120 -87.49 -176.87 5.75 Favored 'General case' 0 CA--C 1.541 0.606 0 C-N-CA 124.341 1.056 . . . . 0.0 111.127 -175.028 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 14.4 p -131.42 156.24 42.49 Favored 'Isoleucine or valine' 0 C--O 1.246 0.914 0 N-CA-C 108.526 -0.916 . . . . 0.0 108.526 178.56 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 65.0 m95 -85.3 133.39 34.15 Favored 'General case' 0 C--N 1.344 0.352 0 N-CA-C 108.448 -0.945 . . . . 0.0 108.448 -179.882 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 57.3 t -102.31 137.24 30.97 Favored 'Isoleucine or valine' 0 C--O 1.237 0.439 0 N-CA-C 108.382 -0.97 . . . . 0.0 108.382 172.201 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.408 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 2.8 tt -115.72 106.61 14.07 Favored 'General case' 0 N--CA 1.452 -0.334 0 N-CA-C 104.373 -2.454 . . . . 0.0 104.373 175.643 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.6 tt0 -116.89 131.17 57.02 Favored 'General case' 0 C--N 1.316 -0.851 0 N-CA-C 107.887 -1.153 . . . . 0.0 107.887 -177.52 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.456 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 43.1 p90 -145.76 158.79 43.83 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 123.334 0.654 . . . . 0.0 110.522 179.583 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 4.9 m-20 -54.21 105.41 0.14 Allowed 'General case' 0 CA--C 1.54 0.588 0 CA-C-N 114.378 -1.283 . . . . 0.0 108.284 170.51 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -40.44 122.57 1.62 Allowed 'General case' 0 N--CA 1.482 1.141 0 C-N-CA 124.719 1.208 . . . . 0.0 112.304 -177.778 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 7.7 pt-20 -70.47 76.79 0.57 Allowed 'General case' 0 CA--C 1.547 0.839 0 CA-C-O 122.344 1.068 . . . . 0.0 110.67 -178.085 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 6.8 p -148.42 134.14 9.6 Favored Pre-proline 0 CA--C 1.546 0.82 0 CA-C-N 114.14 -1.391 . . . . 0.0 107.54 -178.746 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 57.4 Cg_endo -68.21 -168.78 0.22 Allowed 'Trans proline' 0 C--N 1.372 1.804 0 C-N-CA 122.491 2.127 . . . . 0.0 111.883 173.295 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -70.77 3.09 3.46 Favored 'General case' 0 N--CA 1.482 1.158 0 N-CA-C 112.35 0.5 . . . . 0.0 112.35 178.163 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 31.4 mmmt -70.44 75.77 0.56 Allowed 'General case' 0 CA--C 1.543 0.695 0 C-N-CA 124.33 1.052 . . . . 0.0 109.2 169.035 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 23.3 pt -125.06 165.91 21.53 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.821 0 C-N-CA 124.848 1.259 . . . . 0.0 108.894 -178.308 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 19.1 m-20 -67.6 117.85 51.5 Favored Pre-proline 0 CA--C 1.544 0.734 0 N-CA-C 109.923 -0.399 . . . . 0.0 109.923 175.401 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 27.5 Cg_endo -61.06 -18.35 57.41 Favored 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 122.543 2.162 . . . . 0.0 112.179 173.378 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 49.9 mm -64.19 -46.38 93.64 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 124.172 0.989 . . . . 0.0 110.812 174.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 70.5 mtm -114.27 15.2 18.14 Favored 'General case' 0 N--CA 1.486 1.347 0 C-N-CA 123.616 0.766 . . . . 0.0 111.073 -174.664 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.483 ' HA2' ' HB2' ' A' ' 44' ' ' SER . . . -86.17 46.88 3.67 Favored Glycine 0 C--N 1.345 1.078 0 CA-C-N 116.249 -0.432 . . . . 0.0 113.389 -175.82 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 4.8 p90 -161.13 -37.68 0.05 OUTLIER 'General case' 0 N--CA 1.475 0.797 0 C-N-CA 123.9 0.88 . . . . 0.0 109.528 175.912 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 18.7 p -83.54 -71.92 0.48 Allowed 'General case' 0 CA--C 1.549 0.922 0 C-N-CA 123.765 0.826 . . . . 0.0 110.597 176.114 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 19.0 m -71.58 -44.11 65.09 Favored 'General case' 0 N--CA 1.474 0.754 0 C-N-CA 123.793 0.837 . . . . 0.0 110.415 -177.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . 0.483 ' HB2' ' HA2' ' A' ' 40' ' ' GLY . 18.4 m -107.08 82.46 1.69 Allowed 'General case' 0 CA--C 1.537 0.462 0 N-CA-C 108.688 -0.856 . . . . 0.0 108.688 175.568 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 20.3 m -66.78 -23.63 66.09 Favored 'General case' 0 CA--C 1.549 0.939 0 C-N-CA 123.711 0.805 . . . . 0.0 111.82 179.983 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 7.9 p-10 -129.7 -150.97 0.45 Allowed 'General case' 0 CA--C 1.554 1.125 0 C-N-CA 124.041 0.937 . . . . 0.0 109.348 179.318 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 52.5 ttm -51.91 -27.57 13.42 Favored 'General case' 0 N--CA 1.489 1.51 0 C-N-CA 124.343 1.057 . . . . 0.0 112.891 176.536 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 pttp -149.96 -172.04 4.06 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.883 0.873 . . . . 0.0 110.309 -166.233 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 13.8 pt20 -124.61 -160.01 0.91 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.786 0.834 . . . . 0.0 108.828 175.866 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.1 OUTLIER -104.8 154.75 19.62 Favored 'General case' 0 N--CA 1.479 0.999 0 CA-C-O 121.049 0.452 . . . . 0.0 110.34 174.192 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 10.6 p -139.01 142.85 32.99 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.918 0 C-N-CA 124.035 0.934 . . . . 0.0 108.951 174.332 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.408 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 14.5 ptpt -137.75 133.11 33.72 Favored 'General case' 0 N--CA 1.468 0.461 0 CA-C-O 121.592 0.711 . . . . 0.0 112.233 -175.833 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 4.4 mp -119.45 151.09 39.13 Favored 'General case' 0 N--CA 1.471 0.585 0 C-N-CA 125.191 1.396 . . . . 0.0 107.652 177.569 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 25.2 p -118.26 132.54 56.3 Favored 'General case' 0 N--CA 1.481 1.084 0 CA-C-N 118.564 0.62 . . . . 0.0 111.243 178.768 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 95.1 m-85 -132.7 149.53 52.28 Favored 'General case' 0 N--CA 1.481 1.088 0 C-N-CA 125.247 1.419 . . . . 0.0 108.938 -177.787 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.413 ' HB2' HE22 ' A' ' 60' ' ' GLN . 40.3 mt-10 -68.91 -28.19 66.45 Favored 'General case' 0 N--CA 1.484 1.26 0 C-N-CA 122.936 0.494 . . . . 0.0 111.901 -176.138 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.0 p -134.64 162.14 33.15 Favored 'General case' 0 N--CA 1.481 1.083 0 C-N-CA 123.442 0.697 . . . . 0.0 110.909 -178.053 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 40.8 tt0 -60.74 -43.0 98.46 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.622 0.769 . . . . 0.0 111.011 171.857 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 30.4 mt-10 -57.1 -37.5 72.03 Favored 'General case' 0 N--CA 1.472 0.673 0 O-C-N 124.225 0.953 . . . . 0.0 111.779 -175.562 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.413 HE22 ' HB2' ' A' ' 56' ' ' GLU . 48.4 mt-30 -72.91 -32.81 65.59 Favored 'General case' 0 N--CA 1.477 0.883 0 C-N-CA 122.999 0.52 . . . . 0.0 111.442 178.14 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.73 -39.06 57.88 Favored 'General case' 0 N--CA 1.478 0.934 0 CA-C-O 121.403 0.62 . . . . 0.0 110.508 -177.301 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 12.2 pt-20 -74.11 -32.29 63.15 Favored 'General case' 0 N--CA 1.472 0.63 0 CA-C-N 115.507 -0.769 . . . . 0.0 110.952 176.915 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -54.67 -37.91 66.33 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.359 0.663 . . . . 0.0 111.693 174.175 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 71.4 t80 -65.34 -59.78 3.67 Favored 'General case' 0 C--O 1.24 0.588 0 C-N-CA 123.643 0.777 . . . . 0.0 110.416 177.211 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.07 -48.88 70.15 Favored 'General case' 0 CA--C 1.549 0.911 0 C-N-CA 124.394 1.077 . . . . 0.0 112.767 -178.576 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -63.01 -39.71 95.56 Favored 'General case' 0 N--CA 1.485 1.285 0 C-N-CA 124.162 0.985 . . . . 0.0 111.287 -177.934 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 79.4 ttt180 -53.82 -38.22 64.38 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 124.316 1.046 . . . . 0.0 111.322 175.038 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . 0.461 ' HB2' HG13 ' A' ' 70' ' ' ILE . 79.7 mttt -93.27 -18.03 22.94 Favored 'General case' 0 N--CA 1.47 0.554 0 CA-C-N 115.501 -0.772 . . . . 0.0 111.921 -176.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.69 6.76 76.19 Favored Glycine 0 C--N 1.347 1.174 0 CA-C-O 119.775 -0.458 . . . . 0.0 112.195 -172.635 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.461 HG13 ' HB2' ' A' ' 68' ' ' LYS . 67.7 mt -60.5 113.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.552 1.026 0 CA-C-O 121.318 0.58 . . . . 0.0 110.628 178.255 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 2.2 pm0 -56.62 129.97 43.26 Favored 'General case' 0 N--CA 1.478 0.947 0 CA-C-N 113.111 -1.858 . . . . 0.0 108.666 171.13 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 38.9 p90 -141.17 140.23 34.0 Favored 'General case' 0 N--CA 1.473 0.694 0 O-C-N 121.692 -0.63 . . . . 0.0 111.746 -171.745 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 14.2 tpp85 -104.74 122.99 46.84 Favored 'General case' 0 CA--C 1.533 0.304 0 C-N-CA 124.692 1.197 . . . . 0.0 108.937 171.257 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 99.1 t -85.12 125.88 40.37 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.609 0 N-CA-C 109.077 -0.712 . . . . 0.0 109.077 169.515 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.439 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.7 mp -108.41 125.35 65.21 Favored 'Isoleucine or valine' 0 C--O 1.241 0.636 0 C-N-CA 125.397 1.479 . . . . 0.0 107.107 170.205 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 61.7 mt -78.26 141.12 61.62 Favored Pre-proline 0 CA--C 1.545 0.772 0 C-N-CA 122.288 0.235 . . . . 0.0 111.092 179.386 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.534 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 67.9 Cg_endo -83.69 -169.7 0.74 Allowed 'Trans proline' 0 C--N 1.366 1.469 0 C-N-CA 123.464 2.776 . . . . 0.0 112.913 176.875 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -67.9 -12.78 61.36 Favored 'General case' 0 N--CA 1.483 1.193 0 C-N-CA 123.853 0.861 . . . . 0.0 112.364 179.134 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . 0.42 ' HG3' ' H ' ' A' ' 80' ' ' ALA . 6.9 pt-20 -109.02 -65.1 1.17 Allowed 'General case' 0 CA--C 1.552 1.057 0 C-N-CA 124.08 0.952 . . . . 0.0 110.037 -177.659 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.464 ' H ' ' HG2' ' A' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.481 1.083 0 C-N-CA 125.578 1.551 . . . . 0.0 113.025 172.554 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.457 ' SD ' ' N ' ' A' ' 1' ' ' MET . 0.9 OUTLIER . . . . . 0 N--CA 1.484 1.263 0 N-CA-C 108.238 -1.023 . . . . 0.0 108.238 . . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 45.2 p -134.18 95.74 3.48 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 109.346 -0.612 . . . . 0.0 109.346 -167.439 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.469 ' O ' ' HA ' ' A' ' 72' ' ' TYR . . . -98.02 145.07 26.88 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-N 115.631 -0.713 . . . . 0.0 110.055 -172.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 21.6 pttm -113.84 125.28 53.9 Favored 'General case' 0 C--N 1.321 -0.648 0 N-CA-C 106.693 -1.595 . . . . 0.0 106.693 168.122 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.519 ' HB ' HG12 ' A' ' 74' ' ' VAL . 91.6 mt -107.07 121.49 59.98 Favored 'Isoleucine or valine' 0 C--O 1.218 -0.605 0 N-CA-C 107.086 -1.45 . . . . 0.0 107.086 -179.363 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.452 ' HA ' ' O ' ' A' ' 75' ' ' ILE . 30.5 p90 -149.1 174.91 11.82 Favored 'General case' 0 C--N 1.32 -0.715 0 N-CA-C 108.959 -0.756 . . . . 0.0 108.959 -174.345 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . . . . . . . . . 64.7 ttt180 -126.26 99.95 30.27 Favored Pre-proline 0 C--N 1.319 -0.734 0 N-CA-C 107.894 -1.15 . . . . 0.0 107.894 175.535 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.42 ' HD2' ' O ' ' A' ' 22' ' ' VAL . 72.3 Cg_endo -70.01 126.65 13.38 Favored 'Trans proline' 0 C--N 1.368 1.578 0 C-N-CA 123.022 2.481 . . . . 0.0 112.865 -172.501 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.51 -47.52 60.06 Favored 'General case' 0 CA--C 1.54 0.589 0 C-N-CA 123.648 0.779 . . . . 0.0 109.1 170.263 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 20.7 ptmt -90.2 117.32 28.86 Favored 'General case' 0 CA--C 1.545 0.767 0 N-CA-C 108.985 -0.746 . . . . 0.0 108.985 170.435 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 12.2 t -158.21 165.3 35.23 Favored 'General case' 0 N--CA 1.471 0.61 0 C-N-CA 123.48 0.712 . . . . 0.0 110.237 -176.734 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.67 100.28 0.52 Allowed 'General case' 0 C--O 1.242 0.707 0 N-CA-C 108.969 -0.752 . . . . 0.0 108.969 173.975 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.4 ptp -63.18 127.75 32.69 Favored 'General case' 0 CA--C 1.541 0.625 0 C-N-CA 123.475 0.71 . . . . 0.0 110.811 -175.112 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 21.6 tm0? -65.11 -59.95 3.56 Favored 'General case' 0 N--CA 1.472 0.642 0 N-CA-C 108.896 -0.779 . . . . 0.0 108.896 175.059 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.0 t -178.68 -49.24 0.01 OUTLIER 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.373 1.069 . . . . 0.0 108.814 177.937 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 136.9 -24.32 3.15 Favored Glycine 0 N--CA 1.473 1.128 0 CA-C-N 115.748 -0.66 . . . . 0.0 111.645 -177.14 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 9.4 t -67.02 -32.12 73.13 Favored 'General case' 0 CA--C 1.55 0.981 0 C-N-CA 123.408 0.683 . . . . 0.0 111.19 175.641 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -93.69 179.29 5.41 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 123.604 0.762 . . . . 0.0 109.75 171.28 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . 0.599 ' HE2' HG12 ' A' ' 22' ' ' VAL . 34.5 mtmm -65.99 -27.73 68.36 Favored 'General case' 0 N--CA 1.484 1.271 0 N-CA-C 112.442 0.534 . . . . 0.0 112.442 -173.614 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 64.4 p 60.58 -69.74 0.04 OUTLIER 'General case' 0 N--CA 1.489 1.493 0 C-N-CA 126.286 1.834 . . . . 0.0 112.42 -178.591 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 15.2 m120 -72.93 88.77 1.38 Allowed 'General case' 0 N--CA 1.47 0.552 0 N-CA-C 108.842 -0.799 . . . . 0.0 108.842 171.376 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.599 HG12 ' HE2' ' A' ' 19' ' ' LYS . 27.0 m -107.39 175.33 1.36 Allowed 'Isoleucine or valine' 0 N--CA 1.473 0.71 0 N-CA-C 108.258 -1.016 . . . . 0.0 108.258 172.661 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.6 m95 -87.96 125.89 34.76 Favored 'General case' 0 CA--C 1.543 0.69 0 CA-C-N 118.819 0.736 . . . . 0.0 109.448 -177.454 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 76.1 t -101.39 138.97 23.8 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.498 0 CA-C-N 115.789 -0.641 . . . . 0.0 110.039 176.977 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.412 ' O ' ' HA ' ' A' ' 52' ' ' LYS . 9.4 tt -115.22 107.21 14.99 Favored 'General case' 0 CA--C 1.518 -0.267 0 N-CA-C 105.142 -2.17 . . . . 0.0 105.142 175.844 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 29.4 tt0 -116.37 130.4 56.75 Favored 'General case' 0 C--O 1.218 -0.601 0 N-CA-C 108.279 -1.008 . . . . 0.0 108.279 -178.005 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.468 ' O ' ' HA ' ' A' ' 50' ' ' GLN . 45.1 p90 -141.09 154.39 45.9 Favored 'General case' 0 CA--C 1.509 -0.623 0 N-CA-C 109.176 -0.675 . . . . 0.0 109.176 -175.955 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 32.9 t70 -92.09 128.29 37.88 Favored 'General case' 0 C--O 1.241 0.643 0 N-CA-C 107.347 -1.353 . . . . 0.0 107.347 169.785 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -80.25 159.44 25.9 Favored 'General case' 0 N--CA 1.469 0.508 0 CA-C-O 121.678 0.751 . . . . 0.0 111.805 179.741 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.1 OUTLIER -79.58 7.93 7.39 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 114.177 -1.374 . . . . 0.0 111.622 178.553 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.583 ' HB ' ' HG2' ' A' ' 48' ' ' LYS . 9.3 p -47.59 127.66 10.56 Favored Pre-proline 0 CA--C 1.564 1.487 0 C-N-CA 123.872 0.869 . . . . 0.0 112.384 174.323 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 74.0 Cg_endo -71.81 170.37 18.92 Favored 'Trans proline' 0 C--N 1.375 1.948 0 C-N-CA 122.652 2.235 . . . . 0.0 111.991 175.767 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 16.5 ptm180 -62.93 -26.82 68.99 Favored 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.854 175.588 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 34.3 mmtp -78.1 99.09 6.02 Favored 'General case' 0 CA--C 1.546 0.807 0 C-N-CA 123.629 0.772 . . . . 0.0 109.897 -179.211 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 10.9 pt -123.7 179.74 2.61 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.13 0 C-N-CA 124.319 1.048 . . . . 0.0 110.237 -179.111 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 18.7 t70 -60.26 123.15 71.74 Favored Pre-proline 0 N--CA 1.482 1.163 0 C-N-CA 123.109 0.564 . . . . 0.0 111.239 -177.404 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_endo -55.17 -26.07 49.26 Favored 'Trans proline' 0 C--N 1.372 1.789 0 C-N-CA 124.028 3.152 . . . . 0.0 114.044 176.817 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 11.4 mt -81.86 -82.55 0.08 OUTLIER 'Isoleucine or valine' 0 CA--C 1.547 0.862 0 C-N-CA 123.113 0.565 . . . . 0.0 110.563 -173.305 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 24.9 ptm -92.95 4.29 54.23 Favored 'General case' 0 N--CA 1.481 1.093 0 C-N-CA 122.808 0.443 . . . . 0.0 112.079 -173.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . -66.93 -13.51 61.78 Favored Glycine 0 N--CA 1.478 1.477 0 N-CA-C 113.869 0.307 . . . . 0.0 113.869 177.92 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 81.3 t80 -56.42 -36.42 68.94 Favored 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 123.652 0.781 . . . . 0.0 110.347 171.126 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 16.7 p -111.78 99.65 8.31 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.371 1.068 . . . . 0.0 108.672 171.686 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 32.1 t -63.6 -15.45 58.2 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.221 1.009 . . . . 0.0 112.41 -174.891 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 20.1 t -65.53 85.79 0.07 Allowed 'General case' 0 CA--C 1.55 0.95 0 C-N-CA 123.718 0.807 . . . . 0.0 110.713 176.213 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 49.6 m -147.51 -173.8 4.36 Favored 'General case' 0 N--CA 1.479 1.006 0 C-N-CA 123.774 0.83 . . . . 0.0 110.666 -175.12 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 2.6 m-20 -75.4 -17.85 60.09 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.619 0.768 . . . . 0.0 111.128 172.838 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.9 mpt? -58.81 135.89 57.62 Favored 'General case' 0 N--CA 1.476 0.846 0 N-CA-C 109.613 -0.514 . . . . 0.0 109.613 167.44 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.583 ' HG2' ' HB ' ' A' ' 31' ' ' VAL . 0.0 OUTLIER -48.68 133.64 16.88 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 124.16 0.912 . . . . 0.0 111.131 174.328 . . . . . . . . 3 3 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 22.5 pt20 -157.39 -162.12 1.15 Allowed 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 124.297 1.039 . . . . 0.0 109.053 -173.477 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.468 ' HA ' ' O ' ' A' ' 27' ' ' PHE . 25.7 pt20 -75.47 56.89 0.89 Allowed 'General case' 0 CA--C 1.564 1.483 0 C-N-CA 123.094 0.558 . . . . 0.0 111.358 175.243 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 8.5 t -68.41 160.84 4.4 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.165 0 C-N-CA 124.67 1.188 . . . . 0.0 112.33 -167.844 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.412 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 13.2 ptmm? -131.88 136.82 47.72 Favored 'General case' 0 CA--C 1.538 0.481 0 CA-C-N 115.29 -0.868 . . . . 0.0 110.223 171.511 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.3 mp -120.12 144.63 47.53 Favored 'General case' 0 N--CA 1.475 0.812 0 N-CA-C 107.789 -1.189 . . . . 0.0 107.789 176.354 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 19.2 p -111.8 128.86 56.24 Favored 'General case' 0 N--CA 1.473 0.71 0 C-N-CA 123.085 0.554 . . . . 0.0 109.806 -179.237 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.3 m-85 -125.3 156.56 38.45 Favored 'General case' 0 C--O 1.24 0.587 0 C-N-CA 125.05 1.34 . . . . 0.0 108.943 -178.306 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . . . . . . . . . 9.7 mm-40 -61.36 -42.0 97.99 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.246 1.018 . . . . 0.0 111.696 177.108 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 43.0 p -136.5 168.11 20.1 Favored 'General case' 0 C--O 1.243 0.752 0 C-N-CA 124.013 0.925 . . . . 0.0 110.014 -173.958 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 8.0 tt0 -63.33 -37.38 87.04 Favored 'General case' 0 N--CA 1.475 0.805 0 CA-C-N 115.304 -0.862 . . . . 0.0 110.484 173.701 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 14.0 mm-40 -58.55 -41.24 85.15 Favored 'General case' 0 C--N 1.349 0.555 0 O-C-N 124.148 0.905 . . . . 0.0 111.815 -175.802 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . . . . . . . . . 75.6 mt-30 -70.36 -29.51 66.2 Favored 'General case' 0 CA--C 1.545 0.784 0 C-N-CA 122.978 0.511 . . . . 0.0 111.817 179.872 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -77.72 -41.22 38.56 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.088 0.555 . . . . 0.0 110.747 179.876 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 0.2 OUTLIER -73.52 -38.66 65.25 Favored 'General case' 0 N--CA 1.474 0.734 0 CA-C-N 115.73 -0.668 . . . . 0.0 110.648 -177.467 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -58.78 -36.12 73.91 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 123.499 0.72 . . . . 0.0 112.02 172.205 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 82.1 t80 -64.61 -58.26 6.82 Favored 'General case' 0 C--N 1.349 0.548 0 O-C-N 123.68 0.612 . . . . 0.0 110.011 176.324 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.55 -50.06 66.34 Favored 'General case' 0 CA--C 1.543 0.681 0 C-N-CA 124.607 1.163 . . . . 0.0 112.382 -177.509 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.0 mt-30 -60.59 -42.33 96.52 Favored 'General case' 0 N--CA 1.486 1.348 0 C-N-CA 123.672 0.789 . . . . 0.0 111.163 -179.649 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 40.4 ttm180 -61.93 -30.34 70.84 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 124.773 1.229 . . . . 0.0 111.152 178.888 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.61 -14.29 26.66 Favored 'General case' 0 N--CA 1.478 0.957 0 C-N-CA 123.291 0.636 . . . . 0.0 111.274 178.586 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 87.39 2.03 83.13 Favored Glycine 0 C--N 1.351 1.374 0 O-C-N 123.15 0.281 . . . . 0.0 113.018 -175.327 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . 0.404 HG12 ' HB2' ' A' ' 1' ' ' MET . 61.1 mt -62.23 111.91 0.88 Allowed 'Isoleucine or valine' 0 CA--C 1.556 1.184 0 CA-C-O 121.522 0.677 . . . . 0.0 111.121 178.72 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 9.0 pt-20 -61.23 133.31 55.78 Favored 'General case' 0 N--CA 1.488 1.46 0 CA-C-N 113.434 -1.712 . . . . 0.0 108.528 169.895 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . 0.469 ' HA ' ' O ' ' A' ' 3' ' ' ALA . 53.7 p90 -138.77 143.59 39.03 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 119.055 0.843 . . . . 0.0 112.652 -171.927 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 19.0 tpp180 -110.19 110.57 21.46 Favored 'General case' 0 CA--C 1.536 0.441 0 C-N-CA 124.912 1.285 . . . . 0.0 108.567 173.744 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.519 HG12 ' HB ' ' A' ' 5' ' ' ILE . 27.3 m -83.88 128.94 38.37 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.806 0 CA-C-O 121.425 0.631 . . . . 0.0 110.751 176.265 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.452 ' O ' ' HA ' ' A' ' 6' ' ' TYR . 4.2 mp -119.55 126.37 75.26 Favored 'Isoleucine or valine' 0 CA--C 1.535 0.377 0 N-CA-C 105.992 -1.855 . . . . 0.0 105.992 172.739 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.485 ' HB3' ' HB3' ' A' ' 80' ' ' ALA . 45.3 mt -76.56 159.91 78.4 Favored Pre-proline 0 CA--C 1.546 0.811 0 CA-C-O 119.298 -0.382 . . . . 0.0 110.247 177.984 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_endo -61.23 166.89 10.19 Favored 'Trans proline' 0 C--N 1.381 2.249 0 C-N-CA 121.939 1.759 . . . . 0.0 111.337 175.075 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -68.45 11.78 0.16 Allowed 'General case' 0 N--CA 1.493 1.706 0 N-CA-C 115.342 1.608 . . . . 0.0 115.342 -169.461 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.4 pt-20 -145.04 13.93 1.47 Allowed 'General case' 0 CA--C 1.547 0.856 0 C-N-CA 123.922 0.889 . . . . 0.0 111.418 -178.612 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.485 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . . . . . . . . 0 N--CA 1.482 1.164 0 N-CA-C 112.416 0.525 . . . . 0.0 112.416 -175.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.484 1.234 0 N-CA-C 109.026 -0.731 . . . . 0.0 109.026 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 52.3 p -123.72 126.81 47.19 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 123.354 0.662 . . . . 0.0 110.376 -176.124 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -100.83 139.24 36.8 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.328 0.651 . . . . 0.0 110.111 -178.275 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 0.3 OUTLIER -107.46 127.32 53.5 Favored 'General case' 0 CA--C 1.538 0.487 0 N-CA-C 107.018 -1.475 . . . . 0.0 107.018 177.451 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.433 HG21 ' HG3' ' A' ' 58' ' ' GLN . 61.1 mt -107.09 122.94 61.87 Favored 'Isoleucine or valine' 0 CA--C 1.515 -0.397 0 N-CA-C 107.678 -1.23 . . . . 0.0 107.678 175.84 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 22.4 p90 -147.19 176.58 9.86 Favored 'General case' 0 C--N 1.314 -0.96 0 N-CA-C 108.248 -1.019 . . . . 0.0 108.248 178.872 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.538 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 64.6 ttt180 -141.52 96.02 7.05 Favored Pre-proline 0 C--N 1.32 -0.676 0 N-CA-C 107.06 -1.459 . . . . 0.0 107.06 175.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.406 ' HG2' ' O ' ' A' ' 10' ' ' LYS . 74.6 Cg_endo -74.19 -179.3 4.58 Favored 'Trans proline' 0 C--N 1.365 1.44 0 C-N-CA 122.842 2.361 . . . . 0.0 112.754 -170.66 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -93.01 2.89 56.57 Favored 'General case' 0 CA--C 1.549 0.904 0 CA-C-N 115.843 -0.617 . . . . 0.0 111.318 177.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . 0.406 ' O ' ' HG2' ' A' ' 8' ' ' PRO . 7.5 ptpp? -147.44 157.73 43.69 Favored 'General case' 0 N--CA 1.479 0.979 0 C-N-CA 123.605 0.762 . . . . 0.0 110.582 174.244 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 24.6 p -142.32 -52.38 0.4 Allowed 'General case' 0 N--CA 1.482 1.136 0 N-CA-C 107.633 -1.247 . . . . 0.0 107.633 172.809 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -162.1 -65.83 0.05 Allowed 'General case' 0 N--CA 1.471 0.581 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 170.609 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 99.0 mmm -146.2 164.93 30.71 Favored 'General case' 0 N--CA 1.483 1.209 0 C-N-CA 125.629 1.571 . . . . 0.0 107.089 165.735 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 7.6 tt0 -71.61 88.99 0.97 Allowed 'General case' 0 N--CA 1.479 1.005 0 N-CA-C 109.189 -0.671 . . . . 0.0 109.189 178.019 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 26.2 t -160.73 136.89 8.44 Favored 'General case' 0 C--O 1.24 0.598 0 C-N-CA 123.585 0.754 . . . . 0.0 109.042 -177.818 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 66.66 31.39 78.36 Favored Glycine 0 C--N 1.345 1.066 0 O-C-N 123.539 0.525 . . . . 0.0 112.66 -176.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . 0.565 HG22 HG13 ' A' ' 22' ' ' VAL . 33.9 p -122.4 142.16 50.82 Favored 'General case' 0 CA--C 1.545 0.77 0 C-N-CA 124.006 0.922 . . . . 0.0 110.158 -176.832 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -60.76 -40.65 93.29 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.367 0.667 . . . . 0.0 110.993 175.718 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -160.83 128.16 4.26 Favored 'General case' 0 N--CA 1.472 0.651 0 N-CA-C 108.383 -0.969 . . . . 0.0 108.383 175.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 68.5 p 50.46 -85.64 0.01 OUTLIER 'General case' 0 N--CA 1.489 1.506 0 C-N-CA 125.131 1.372 . . . . 0.0 112.731 178.961 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.5 m-80 -124.33 154.66 39.98 Favored 'General case' 0 C--N 1.349 0.56 0 C-N-CA 124.28 1.032 . . . . 0.0 108.31 177.125 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . 0.565 HG13 HG22 ' A' ' 17' ' ' THR . 3.6 m -88.4 170.44 1.25 Allowed 'Isoleucine or valine' 0 C--O 1.244 0.782 0 CA-C-O 121.139 0.495 . . . . 0.0 110.793 176.219 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 63.4 m95 -84.06 122.21 28.48 Favored 'General case' 0 C--O 1.235 0.324 0 N-CA-C 107.517 -1.29 . . . . 0.0 107.517 178.751 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . 0.5 HG22 HG22 ' A' ' 54' ' ' THR . 56.0 t -100.93 138.72 24.22 Favored 'Isoleucine or valine' 0 C--N 1.324 -0.526 0 CA-C-N 115.529 -0.759 . . . . 0.0 109.53 -177.088 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 43.3 tp -117.43 105.06 11.72 Favored 'General case' 0 N--CA 1.454 -0.225 0 N-CA-C 107.172 -1.418 . . . . 0.0 107.172 -177.693 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 45.0 tt0 -117.11 130.18 56.46 Favored 'General case' 0 C--O 1.219 -0.523 0 N-CA-C 108.251 -1.018 . . . . 0.0 108.251 -176.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 53.3 p90 -143.97 156.94 44.6 Favored 'General case' 0 CA--C 1.51 -0.577 0 C-N-CA 123.105 0.562 . . . . 0.0 110.224 -177.28 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . 0.615 ' HA ' ' HG2' ' A' ' 50' ' ' GLN . 34.6 t70 -61.12 105.71 0.52 Allowed 'General case' 0 C--O 1.236 0.346 0 N-CA-C 108.007 -1.108 . . . . 0.0 108.007 168.709 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.686 ' HB1' HG12 ' A' ' 31' ' ' VAL . . . -55.0 124.8 17.92 Favored 'General case' 0 CA--C 1.537 0.453 0 O-C-N 124.272 0.982 . . . . 0.0 111.669 -170.228 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 9.9 pt-20 -86.62 29.08 0.81 Allowed 'General case' 0 N--CA 1.476 0.85 0 C-N-CA 123.439 0.695 . . . . 0.0 110.127 173.768 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.686 HG12 ' HB1' ' A' ' 29' ' ' ALA . 10.1 p -128.72 123.51 22.13 Favored Pre-proline 0 CA--C 1.553 1.078 0 C-N-CA 123.41 0.684 . . . . 0.0 110.355 -173.636 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.445 ' HB2' ' HD3' ' A' ' 33' ' ' ARG . 44.5 Cg_endo -87.18 -148.47 0.03 OUTLIER 'Trans proline' 0 C--N 1.371 1.711 0 C-N-CA 123.188 2.592 . . . . 0.0 110.705 166.141 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.445 ' HD3' ' HB2' ' A' ' 32' ' ' PRO . 0.0 OUTLIER -55.42 -30.17 59.95 Favored 'General case' 0 N--CA 1.485 1.319 0 C-N-CA 123.361 0.664 . . . . 0.0 112.301 169.435 . . . . . . . . 3 3 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 23.8 tptp -77.94 90.79 4.15 Favored 'General case' 0 C--N 1.356 0.861 0 N-CA-C 109.084 -0.71 . . . . 0.0 109.084 -179.762 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.682 ' HB ' ' HA2' ' A' ' 40' ' ' GLY . 2.7 pp -99.25 153.36 4.28 Favored 'Isoleucine or valine' 0 CA--C 1.539 0.538 0 CA-C-N 114.91 -1.041 . . . . 0.0 112.175 -169.926 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 8.5 m-20 -76.25 145.55 76.67 Favored Pre-proline 0 N--CA 1.477 0.923 0 C-N-CA 122.693 0.397 . . . . 0.0 110.14 171.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 57.8 Cg_endo -68.55 -5.77 16.07 Favored 'Trans proline' 0 C--N 1.374 1.904 0 C-N-CA 122.487 2.124 . . . . 0.0 112.411 173.368 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 44.2 mm -64.05 -75.15 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.55 0.953 0 C-N-CA 123.495 0.718 . . . . 0.0 109.668 173.304 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 61.9 mtm -94.5 -71.77 0.65 Allowed 'General case' 0 N--CA 1.474 0.758 0 N-CA-C 108.647 -0.872 . . . . 0.0 108.647 -178.906 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.682 ' HA2' ' HB ' ' A' ' 35' ' ' ILE . . . 63.53 24.06 67.42 Favored Glycine 0 C--N 1.348 1.21 0 N-CA-C 115.309 0.884 . . . . 0.0 115.309 171.336 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 15.7 p90 -95.6 10.81 35.43 Favored 'General case' 0 N--CA 1.478 0.974 0 CA-C-N 117.278 0.539 . . . . 0.0 111.394 -177.594 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 17.0 m -82.84 61.7 6.03 Favored 'General case' 0 CA--C 1.554 1.099 0 CA-C-O 122.218 1.009 . . . . 0.0 109.491 175.303 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.5 m -74.64 -12.24 60.39 Favored 'General case' 0 N--CA 1.475 0.821 0 CA-C-N 114.846 -1.07 . . . . 0.0 111.261 177.616 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 17.0 p -55.56 -44.85 77.23 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.878 1.271 . . . . 0.0 111.105 175.318 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 42.5 t 63.49 12.45 6.4 Favored 'General case' 0 N--CA 1.486 1.345 0 C-N-CA 124.569 1.148 . . . . 0.0 112.029 177.919 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 29.8 t70 -92.24 77.59 5.21 Favored 'General case' 0 CA--C 1.544 0.744 0 C-N-CA 123.27 0.628 . . . . 0.0 110.187 -170.722 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 0.6 OUTLIER 63.02 -75.21 0.04 OUTLIER 'General case' 0 N--CA 1.488 1.457 0 C-N-CA 125.188 1.395 . . . . 0.0 111.172 -178.546 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -165.38 145.32 6.8 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 124.683 1.193 . . . . 0.0 109.086 169.781 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 3.9 pt20 -100.43 -153.6 0.45 Allowed 'General case' 0 N--CA 1.476 0.859 0 N-CA-C 108.801 -0.815 . . . . 0.0 108.801 174.35 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.615 ' HG2' ' HA ' ' A' ' 28' ' ' ASP . 46.9 mt-30 -123.77 100.49 6.8 Favored 'General case' 0 C--O 1.24 0.553 0 N-CA-C 107.959 -1.126 . . . . 0.0 107.959 165.519 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.478 ' H ' ' HB2' ' A' ' 29' ' ' ALA . 31.0 m -82.57 164.02 2.91 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.757 0 CA-C-N 118.17 0.441 . . . . 0.0 111.022 -179.894 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . . . . . . . . . 16.4 ptmt -146.17 142.84 28.85 Favored 'General case' 0 N--CA 1.466 0.343 0 CA-C-N 115.18 -0.918 . . . . 0.0 112.164 -178.236 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 5.0 mp -116.77 158.58 23.66 Favored 'General case' 0 N--CA 1.469 0.521 0 C-N-CA 125.819 1.648 . . . . 0.0 108.106 -177.899 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . 0.5 HG22 HG22 ' A' ' 24' ' ' VAL . 17.0 p -122.84 133.87 54.42 Favored 'General case' 0 CA--C 1.545 0.776 0 C-N-CA 123.656 0.782 . . . . 0.0 110.973 175.492 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . 0.401 ' O ' ' HB ' ' A' ' 22' ' ' VAL . 98.8 m-85 -135.15 153.06 52.11 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 124.277 1.031 . . . . 0.0 109.897 -178.679 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.476 ' HB2' HE22 ' A' ' 60' ' ' GLN . 6.2 mm-40 -62.85 -32.42 73.64 Favored 'General case' 0 N--CA 1.485 1.316 0 C-N-CA 123.26 0.624 . . . . 0.0 111.356 -179.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 34.6 p -135.5 162.11 33.6 Favored 'General case' 0 C--O 1.243 0.744 0 C-N-CA 123.734 0.814 . . . . 0.0 111.127 -174.984 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . 0.433 ' HG3' HG21 ' A' ' 5' ' ' ILE . 41.6 tt0 -58.43 -41.9 86.09 Favored 'General case' 0 N--CA 1.475 0.793 0 CA-C-N 114.568 -1.196 . . . . 0.0 110.705 170.667 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 39.6 mt-10 -49.36 -47.7 47.26 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 125.137 1.375 . . . . 0.0 112.563 -178.284 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.476 HE22 ' HB2' ' A' ' 56' ' ' GLU . 50.9 mt-30 -69.32 -30.73 68.85 Favored 'General case' 0 CA--C 1.546 0.805 0 C-N-CA 123.458 0.703 . . . . 0.0 111.7 -178.133 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -75.6 -42.51 51.73 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 122.893 0.477 . . . . 0.0 111.139 -179.338 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 13.2 pt-20 -72.18 -39.27 68.78 Favored 'General case' 0 N--CA 1.471 0.618 0 CA-C-N 115.493 -0.776 . . . . 0.0 111.455 179.56 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.7 -33.37 74.96 Favored 'General case' 0 CA--C 1.54 0.596 0 C-N-CA 122.775 0.43 . . . . 0.0 111.956 176.247 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 92.6 t80 -66.13 -56.58 10.73 Favored 'General case' 0 N--CA 1.478 0.925 0 N-CA-C 109.92 -0.4 . . . . 0.0 109.92 174.617 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -53.26 -48.71 68.03 Favored 'General case' 0 CA--C 1.549 0.923 0 C-N-CA 124.468 1.107 . . . . 0.0 111.903 179.922 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -64.66 -40.42 95.4 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.821 0.848 . . . . 0.0 111.514 -178.643 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 61.9 ttt180 -56.09 -35.51 67.11 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.928 1.291 . . . . 0.0 111.081 173.141 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 74.7 mmtt -85.75 -23.11 27.43 Favored 'General case' 0 CA--C 1.544 0.726 0 C-N-CA 123.789 0.836 . . . . 0.0 110.844 179.054 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.56 -0.75 65.7 Favored Glycine 0 C--N 1.348 1.233 0 CA-C-O 120.089 -0.284 . . . . 0.0 112.415 -172.787 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 50.9 mt -65.44 108.21 0.83 Allowed 'Isoleucine or valine' 0 CA--C 1.55 0.949 0 CA-C-O 121.789 0.804 . . . . 0.0 109.459 178.038 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 7.1 pt-20 -55.09 139.75 40.45 Favored 'General case' 0 N--CA 1.484 1.252 0 CA-C-N 113.173 -1.831 . . . . 0.0 108.74 169.001 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -136.58 145.59 45.13 Favored 'General case' 0 N--CA 1.479 1.022 0 CA-C-N 118.866 0.757 . . . . 0.0 111.657 -171.963 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 17.7 tpt180 -118.21 130.0 55.82 Favored 'General case' 0 N--CA 1.466 0.356 0 C-N-CA 124.703 1.201 . . . . 0.0 108.438 172.699 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 48.6 t -102.43 132.52 48.31 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.703 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.904 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.5 mp -114.97 121.81 67.81 Favored 'Isoleucine or valine' 0 C--O 1.242 0.687 0 N-CA-C 106.702 -1.592 . . . . 0.0 106.702 176.436 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 58.9 mt -62.18 137.11 95.72 Favored Pre-proline 0 CA--C 1.545 0.761 0 C-N-CA 122.777 0.431 . . . . 0.0 111.265 -179.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.538 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 84.8 Cg_endo -81.39 179.22 5.99 Favored 'Trans proline' 0 C--N 1.363 1.311 0 C-N-CA 123.356 2.704 . . . . 0.0 114.229 -178.601 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -62.32 -22.6 66.19 Favored 'General case' 0 CA--C 1.553 1.066 0 CA-C-N 114.169 -1.378 . . . . 0.0 112.669 178.385 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 10.2 pt-20 -127.15 53.71 1.7 Allowed 'General case' 0 N--CA 1.483 1.191 0 CA-C-O 122.277 1.037 . . . . 0.0 109.376 173.831 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 0.863 0 CA-C-N 114.49 -1.232 . . . . 0.0 111.64 177.835 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.411 ' HG3' ' HG2' ' A' ' 30' ' ' GLU . 67.1 mtm . . . . . 0 N--CA 1.477 0.903 0 N-CA-C 109.507 -0.553 . . . . 0.0 109.507 . . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 41.9 m -127.21 112.35 15.01 Favored 'General case' 0 N--CA 1.467 0.398 0 N-CA-C 106.682 -1.599 . . . . 0.0 106.682 175.348 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -98.85 127.62 44.83 Favored 'General case' 0 N--CA 1.472 0.644 0 N-CA-C 109.619 -0.512 . . . . 0.0 109.619 -169.853 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 22.8 pttm -109.5 122.1 46.66 Favored 'General case' 0 C--O 1.239 0.55 0 N-CA-C 107.107 -1.442 . . . . 0.0 107.107 177.098 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.483 HG13 HD23 ' A' ' 25' ' ' LEU . 3.6 mp -103.6 119.79 52.71 Favored 'Isoleucine or valine' 0 CA--C 1.511 -0.53 0 N-CA-C 105.999 -1.852 . . . . 0.0 105.999 -178.881 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . 0.427 ' HB3' ' HB ' ' A' ' 75' ' ' ILE . 42.8 p90 -143.84 176.45 9.24 Favored 'General case' 0 C--N 1.313 -0.995 0 N-CA-C 108.233 -1.025 . . . . 0.0 108.233 -178.914 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.639 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 78.2 ttt180 -142.68 100.81 5.53 Favored Pre-proline 0 C--N 1.314 -0.954 0 N-CA-C 107.847 -1.168 . . . . 0.0 107.847 -179.421 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 5.8 Cg_exo -72.77 127.57 12.44 Favored 'Trans proline' 0 C--N 1.368 1.568 0 C-N-CA 122.089 1.859 . . . . 0.0 110.625 -177.193 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -66.61 -29.65 69.74 Favored 'General case' 0 CA--C 1.549 0.913 0 CA-C-O 121.324 0.583 . . . . 0.0 109.743 171.32 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 0.1 OUTLIER -88.1 6.0 38.46 Favored 'General case' 0 CA--C 1.551 0.997 0 C-N-CA 124.469 1.108 . . . . 0.0 112.706 -178.903 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 6.6 t -68.4 -28.75 67.37 Favored 'General case' 0 N--CA 1.489 1.497 0 CA-C-N 118.552 0.615 . . . . 0.0 111.176 -178.729 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -161.33 162.29 30.81 Favored 'General case' 0 C--O 1.241 0.645 0 C-N-CA 124.616 1.166 . . . . 0.0 109.297 179.09 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 21.5 ptp -63.52 107.56 1.16 Allowed 'General case' 0 CA--C 1.55 0.974 0 C-N-CA 123.353 0.661 . . . . 0.0 110.334 179.619 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 48.9 mt-30 -63.32 102.1 0.37 Allowed 'General case' 0 N--CA 1.473 0.705 0 C-N-CA 123.864 0.866 . . . . 0.0 110.835 -179.442 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.7 t -91.14 29.64 1.37 Allowed 'General case' 0 N--CA 1.481 1.091 0 C-N-CA 123.914 0.885 . . . . 0.0 111.233 -173.573 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 68.71 32.18 74.05 Favored Glycine 0 C--N 1.349 1.265 0 CA-C-N 116.383 -0.371 . . . . 0.0 112.604 -176.005 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 7.1 t -143.8 157.8 44.13 Favored 'General case' 0 C--O 1.244 0.785 0 C-N-CA 123.676 0.79 . . . . 0.0 110.17 -177.382 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . 0.463 ' HB1' HH22 ' A' ' 7' ' ' ARG . . . -74.56 -29.38 61.33 Favored 'General case' 0 CA--C 1.54 0.561 0 CA-C-N 115.192 -0.913 . . . . 0.0 111.064 178.276 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 50.2 tptt -61.33 -36.22 79.54 Favored 'General case' 0 N--CA 1.486 1.339 0 C-N-CA 123.214 0.606 . . . . 0.0 112.14 -175.714 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 17.3 p -70.54 -5.44 28.98 Favored 'General case' 0 N--CA 1.489 1.495 0 N-CA-C 112.918 0.71 . . . . 0.0 112.918 -178.96 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 13.5 m120 -127.55 110.23 12.51 Favored 'General case' 0 N--CA 1.469 0.502 0 N-CA-C 108.707 -0.849 . . . . 0.0 108.707 171.208 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 34.7 m -105.77 165.16 3.96 Favored 'Isoleucine or valine' 0 C--O 1.245 0.864 0 N-CA-C 109.015 -0.735 . . . . 0.0 109.015 173.453 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . 0.431 ' NE1' ' HD2' ' A' ' 7' ' ' ARG . 66.4 m95 -90.35 131.83 35.92 Favored 'General case' 0 CA--C 1.538 0.493 0 C-N-CA 123.856 0.862 . . . . 0.0 109.039 -176.742 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 88.8 t -100.08 139.3 21.92 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.601 0 CA-C-N 115.22 -0.9 . . . . 0.0 109.257 177.521 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 53' ' ' LEU . 3.4 tm? -111.34 105.2 13.78 Favored 'General case' 0 C--N 1.344 0.353 0 N-CA-C 104.95 -2.241 . . . . 0.0 104.95 175.001 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . 0.654 ' HG2' ' HB3' ' A' ' 52' ' ' LYS . 1.8 tm-20 -116.25 124.44 50.21 Favored 'General case' 0 C--N 1.318 -0.798 0 N-CA-C 106.223 -1.769 . . . . 0.0 106.223 -174.602 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . . . . . . . . . 22.6 p90 -140.9 153.27 45.61 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 119.317 0.962 . . . . 0.0 111.667 -174.835 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 20.6 t70 -59.6 90.91 0.02 OUTLIER 'General case' 0 CA--C 1.543 0.711 0 C-N-CA 124.545 1.138 . . . . 0.0 110.444 170.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.499 ' HB2' HG22 ' A' ' 51' ' ' VAL . . . -76.87 92.35 3.63 Favored 'General case' 0 C--O 1.239 0.507 0 C-N-CA 123.819 0.848 . . . . 0.0 110.776 -175.122 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.411 ' HG2' ' HG3' ' A' ' 1' ' ' MET . 12.3 pt-20 -79.47 61.82 3.62 Favored 'General case' 0 CA--C 1.55 0.958 0 CA-C-O 122.173 0.987 . . . . 0.0 110.213 175.336 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.4 p -66.77 123.95 87.28 Favored Pre-proline 0 CA--C 1.551 1.001 0 CA-C-N 114.905 -1.043 . . . . 0.0 110.101 -178.612 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 88.7 Cg_endo -76.34 109.34 2.85 Favored 'Trans proline' 0 C--N 1.361 1.215 0 C-N-CA 121.919 1.746 . . . . 0.0 110.838 173.135 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -97.39 -40.41 8.72 Favored 'General case' 0 N--CA 1.476 0.826 0 N-CA-C 109.098 -0.704 . . . . 0.0 109.098 -177.84 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 14.5 mmmm 60.87 89.91 0.07 Allowed 'General case' 0 C--N 1.354 0.763 0 O-C-N 125.087 1.492 . . . . 0.0 110.697 176.381 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.639 ' HA ' ' SD ' ' A' ' 39' ' ' MET . 2.8 pp -61.1 133.06 26.92 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.933 0 CA-C-O 121.4 0.619 . . . . 0.0 111.179 -173.921 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 22.8 t70 -119.41 150.74 50.23 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.451 1.1 . . . . 0.0 108.678 -173.293 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 1.0 OUTLIER -43.24 -37.4 7.0 Favored 'Trans proline' 0 C--N 1.379 2.14 0 C-N-CA 123.818 3.012 . . . . 0.0 114.274 172.01 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 38.8 mm -73.16 -30.72 32.18 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.325 0 C-N-CA 123.017 0.527 . . . . 0.0 110.899 -178.246 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.639 ' SD ' ' HA ' ' A' ' 35' ' ' ILE . 64.9 mtt -62.22 -49.83 74.2 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 122.552 0.341 . . . . 0.0 110.097 173.105 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 79.16 -32.47 2.02 Favored Glycine 0 CA--C 1.537 1.427 0 N-CA-C 115.626 1.01 . . . . 0.0 115.626 170.538 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 2.3 p90 -84.35 47.18 1.31 Allowed 'General case' 0 N--CA 1.485 1.317 0 C-N-CA 123.999 0.919 . . . . 0.0 111.757 -169.368 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 6.6 m -61.4 -26.42 67.84 Favored 'General case' 0 CA--C 1.556 1.195 0 C-N-CA 123.873 0.869 . . . . 0.0 111.921 -174.035 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 47.6 p -74.32 -43.24 57.5 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.78 0.432 . . . . 0.0 111.174 175.283 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 41.9 m -93.17 10.32 32.24 Favored 'General case' 0 N--CA 1.485 1.311 0 C-N-CA 123.195 0.598 . . . . 0.0 112.511 -176.47 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 80.3 p -71.63 92.94 1.2 Allowed 'General case' 0 CA--C 1.545 0.768 0 N-CA-C 109.183 -0.673 . . . . 0.0 109.183 174.571 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 8.3 p-10 -76.46 172.2 13.34 Favored 'General case' 0 C--O 1.24 0.603 0 CA-C-N 115.384 -0.826 . . . . 0.0 111.348 -174.461 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 23.5 ptp -71.66 177.77 3.94 Favored 'General case' 0 CA--C 1.543 0.7 0 CA-C-N 115.12 -0.945 . . . . 0.0 111.217 -179.628 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.411 ' HB2' ' O ' ' A' ' 29' ' ' ALA . 0.0 OUTLIER -56.54 145.4 28.21 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.926 0.89 . . . . 0.0 111.84 175.735 . . . . . . . . 3 3 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.4 pt20 -99.39 -165.11 1.19 Allowed 'General case' 0 N--CA 1.476 0.839 0 CA-C-N 115.48 -0.782 . . . . 0.0 109.785 176.298 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 0.4 OUTLIER -137.37 117.57 13.53 Favored 'General case' 0 CA--C 1.539 0.554 0 N-CA-C 109.201 -0.666 . . . . 0.0 109.201 177.456 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.499 HG22 ' HB2' ' A' ' 29' ' ' ALA . 32.1 m -106.5 168.54 2.92 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.782 0 C-N-CA 124.138 0.975 . . . . 0.0 110.825 -179.365 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.654 ' HB3' ' HG2' ' A' ' 26' ' ' GLU . 4.5 ptpp? -133.72 142.7 48.08 Favored 'General case' 0 N--CA 1.472 0.651 0 CA-C-O 122.234 1.016 . . . . 0.0 112.356 -171.946 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . 0.508 HD12 HD12 ' A' ' 25' ' ' LEU . 48.9 mt -118.56 154.0 33.31 Favored 'General case' 0 N--CA 1.465 0.283 0 C-N-CA 125.944 1.698 . . . . 0.0 107.213 177.404 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 8.6 p -121.36 130.91 53.88 Favored 'General case' 0 CA--C 1.541 0.634 0 CA-C-N 119.06 0.845 . . . . 0.0 110.134 174.673 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 97.9 m-85 -129.1 153.49 47.61 Favored 'General case' 0 N--CA 1.467 0.425 0 C-N-CA 125.836 1.655 . . . . 0.0 108.549 178.611 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.407 ' HB2' HE22 ' A' ' 60' ' ' GLN . 24.3 mm-40 -67.0 -32.9 74.45 Favored 'General case' 0 N--CA 1.479 0.99 0 C-N-CA 122.789 0.436 . . . . 0.0 111.835 -179.53 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 40.5 p -134.69 160.61 37.58 Favored 'General case' 0 N--CA 1.477 0.924 0 C-N-CA 123.415 0.686 . . . . 0.0 111.226 -175.195 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 48.5 tt0 -58.84 -45.53 89.84 Favored 'General case' 0 N--CA 1.48 1.051 0 CA-C-N 114.997 -1.001 . . . . 0.0 111.224 174.386 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 41.6 mt-10 -50.42 -42.43 53.87 Favored 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 124.635 1.174 . . . . 0.0 112.831 -179.229 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.407 HE22 ' HB2' ' A' ' 56' ' ' GLU . 47.6 mt-30 -71.26 -30.89 66.85 Favored 'General case' 0 N--CA 1.479 1.022 0 C-N-CA 123.173 0.589 . . . . 0.0 112.17 -178.059 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.41 -39.79 24.41 Favored 'General case' 0 N--CA 1.48 1.072 0 C-N-CA 123.413 0.685 . . . . 0.0 111.188 -178.239 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -76.37 -39.87 52.64 Favored 'General case' 0 N--CA 1.473 0.683 0 CA-C-N 114.636 -1.165 . . . . 0.0 111.229 -178.04 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -67.91 -25.88 65.71 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 123.423 0.689 . . . . 0.0 111.599 178.407 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 39.2 t80 -65.36 -52.44 53.68 Favored 'General case' 0 N--CA 1.471 0.625 0 N-CA-C 109.129 -0.693 . . . . 0.0 109.129 172.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.05 -46.47 75.36 Favored 'General case' 0 CA--C 1.552 1.035 0 C-N-CA 124.089 0.956 . . . . 0.0 111.415 176.297 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 -58.73 -47.44 84.59 Favored 'General case' 0 N--CA 1.485 1.312 0 C-N-CA 124.424 1.09 . . . . 0.0 111.222 179.54 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 28.0 ttm-85 -59.46 -32.46 70.26 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 125.136 1.375 . . . . 0.0 111.576 -178.832 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -94.54 -12.2 28.04 Favored 'General case' 0 CA--C 1.544 0.726 0 CA-C-N 115.258 -0.883 . . . . 0.0 111.422 -179.684 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 90.97 -4.97 81.94 Favored Glycine 0 C--N 1.352 1.447 0 CA-C-O 119.921 -0.377 . . . . 0.0 112.732 -178.187 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 58.6 mt -57.44 113.65 0.62 Allowed 'Isoleucine or valine' 0 C--N 1.358 0.947 0 C-N-CA 123.656 0.782 . . . . 0.0 110.883 -177.06 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 5.7 pt-20 -55.82 134.17 51.61 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 113.433 -1.712 . . . . 0.0 108.648 170.829 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 36.5 p90 -143.06 149.8 38.69 Favored 'General case' 0 C--N 1.347 0.458 0 CA-C-N 118.237 0.471 . . . . 0.0 110.81 -174.325 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 0.6 OUTLIER -133.51 141.17 47.63 Favored 'General case' 0 N--CA 1.476 0.863 0 N-CA-C 107.276 -1.379 . . . . 0.0 107.276 171.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.474 HG12 ' HB ' ' A' ' 5' ' ' ILE . 18.0 m -103.86 139.97 23.33 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 CA-C-O 121.131 0.491 . . . . 0.0 111.18 -174.806 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . 0.427 ' HB ' ' HB3' ' A' ' 6' ' ' TYR . 3.4 mp -109.29 121.94 63.13 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.623 0 N-CA-C 107.094 -1.447 . . . . 0.0 107.094 171.786 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 53.5 mt -76.17 142.2 71.68 Favored Pre-proline 0 CA--C 1.55 0.979 0 C-N-CA 122.77 0.428 . . . . 0.0 111.169 -179.232 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.639 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 72.1 Cg_endo -76.74 -174.02 1.98 Allowed 'Trans proline' 0 C--N 1.373 1.826 0 C-N-CA 123.234 2.623 . . . . 0.0 112.947 -179.871 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -65.0 -34.3 78.12 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 115.675 -0.693 . . . . 0.0 110.677 -176.197 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 9.8 pt-20 -82.98 -53.58 5.72 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 123.729 0.812 . . . . 0.0 109.444 176.509 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.506 ' H ' ' HG2' ' A' ' 77' ' ' PRO . . . . . . . . 0 N--CA 1.484 1.253 0 C-N-CA 125.357 1.463 . . . . 0.0 113.873 179.247 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.3 mpt? . . . . . 0 N--CA 1.481 1.099 0 N-CA-C 109.446 -0.576 . . . . 0.0 109.446 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 34.6 t -140.11 166.17 25.39 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 108.193 -1.039 . . . . 0.0 108.193 -169.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . . . . . . . . . . . -160.94 156.15 24.44 Favored 'General case' 0 N--CA 1.483 1.216 0 N-CA-C 113.874 1.064 . . . . 0.0 113.874 -173.718 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 9.2 ptpp? -113.0 126.36 55.42 Favored 'General case' 0 CA--C 1.555 1.166 0 C-N-CA 124.924 1.29 . . . . 0.0 109.099 164.705 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . . . . . . . . . 69.1 mt -103.21 129.6 54.76 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.801 0 N-CA-C 107.485 -1.302 . . . . 0.0 107.485 171.582 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 20.2 p90 -154.03 -179.14 7.6 Favored 'General case' 0 C--N 1.324 -0.537 0 C-N-CA 123.857 0.863 . . . . 0.0 109.552 176.113 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.533 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 37.1 ttt180 -141.39 99.36 6.43 Favored Pre-proline 0 C--O 1.241 0.614 0 N-CA-C 106.957 -1.497 . . . . 0.0 106.957 174.254 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . 0.525 ' HG2' ' HA ' ' A' ' 11' ' ' THR . 56.1 Cg_endo -66.86 125.95 14.53 Favored 'Trans proline' 0 C--N 1.368 1.572 0 C-N-CA 122.713 2.275 . . . . 0.0 112.523 -172.021 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -63.7 -36.26 83.26 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.956 0.902 . . . . 0.0 110.263 175.674 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -71.55 -29.08 64.33 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 123.676 0.791 . . . . 0.0 110.77 174.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . 0.525 ' HA ' ' HG2' ' A' ' 8' ' ' PRO . 18.8 m 66.69 -74.5 0.06 Allowed 'General case' 0 C--N 1.355 0.837 0 C-N-CA 125.441 1.496 . . . . 0.0 111.727 -178.186 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -62.81 125.06 22.69 Favored 'General case' 0 N--CA 1.472 0.645 0 C-N-CA 123.745 0.818 . . . . 0.0 110.974 179.945 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . 0.553 ' SD ' ' HE3' ' A' ' 52' ' ' LYS . 52.8 mtt -106.68 -40.32 5.57 Favored 'General case' 0 N--CA 1.476 0.868 0 C-N-CA 123.78 0.832 . . . . 0.0 108.808 177.06 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 53.0 tt0 -160.67 87.49 0.75 Allowed 'General case' 0 CA--C 1.542 0.668 0 CA-C-N 114.952 -1.022 . . . . 0.0 108.594 170.331 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 22.6 t -167.54 -34.35 0.02 OUTLIER 'General case' 0 N--CA 1.48 1.036 0 C-N-CA 123.824 0.85 . . . . 0.0 110.525 179.857 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . 76.93 47.45 9.46 Favored Glycine 0 C--N 1.35 1.332 0 O-C-N 123.323 0.389 . . . . 0.0 112.489 -179.065 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 68.1 p -103.95 166.58 10.32 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 124.109 0.964 . . . . 0.0 110.425 179.569 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -72.28 160.46 32.35 Favored 'General case' 0 C--O 1.243 0.722 0 CA-C-N 115.888 -0.596 . . . . 0.0 110.276 175.864 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 3.8 mppt? -77.56 78.29 4.07 Favored 'General case' 0 CA--C 1.546 0.791 0 C-N-CA 123.078 0.551 . . . . 0.0 109.954 179.707 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . 0.478 HG22 HG21 ' A' ' 11' ' ' THR . 8.9 t -84.84 -27.52 26.69 Favored 'General case' 0 N--CA 1.476 0.842 0 C-N-CA 123.51 0.724 . . . . 0.0 110.335 178.541 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 0.8 OUTLIER 62.89 94.48 0.05 OUTLIER 'General case' 0 CA--C 1.546 0.792 0 C-N-CA 125.178 1.391 . . . . 0.0 111.382 179.855 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 8.1 p -115.07 146.51 19.41 Favored 'Isoleucine or valine' 0 C--O 1.245 0.844 0 N-CA-C 107.621 -1.252 . . . . 0.0 107.621 172.721 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 71.9 m95 -75.93 125.8 29.8 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 108.413 -0.958 . . . . 0.0 108.413 -173.105 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 90.9 t -102.07 139.22 23.7 Favored 'Isoleucine or valine' 0 C--N 1.32 -0.674 0 N-CA-C 109.863 -0.421 . . . . 0.0 109.863 179.039 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 50.9 tp -116.11 105.97 13.2 Favored 'General case' 0 N--CA 1.453 -0.293 0 N-CA-C 105.878 -1.897 . . . . 0.0 105.878 169.071 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 23.7 tt0 -104.32 133.35 49.36 Favored 'General case' 0 C--N 1.318 -0.791 0 N-CA-C 106.158 -1.793 . . . . 0.0 106.158 178.003 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.484 ' O ' ' HA ' ' A' ' 50' ' ' GLN . 27.9 p90 -144.98 149.52 35.32 Favored 'General case' 0 N--CA 1.474 0.731 0 CA-C-N 118.951 0.796 . . . . 0.0 112.019 -175.278 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 1.0 OUTLIER -59.6 91.28 0.02 OUTLIER 'General case' 0 C--O 1.242 0.687 0 O-C-N 124.411 1.07 . . . . 0.0 109.093 165.833 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . 0.528 ' HB2' HG22 ' A' ' 51' ' ' VAL . . . -73.53 136.77 44.11 Favored 'General case' 0 C--O 1.233 0.226 0 CA-C-N 114.877 -1.056 . . . . 0.0 109.646 -179.912 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER -70.65 -11.93 61.24 Favored 'General case' 0 CA--C 1.544 0.713 0 C-N-CA 124.35 1.06 . . . . 0.0 111.734 176.55 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . 0.631 HG13 ' HA ' ' A' ' 48' ' ' LYS . 3.0 p -23.53 96.77 0.06 OUTLIER Pre-proline 0 N--CA 1.493 1.723 0 C-N-CA 126.647 1.979 . . . . 0.0 114.288 -173.664 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . . . . . . . . . 35.7 Cg_endo -87.16 -161.67 0.13 Allowed 'Trans proline' 0 C--N 1.381 2.257 0 C-N-CA 123.581 2.854 . . . . 0.0 111.843 -178.218 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . . . . . . . . . 0.0 OUTLIER -63.99 -32.03 73.42 Favored 'General case' 0 CA--C 1.551 1.016 0 CA-C-N 115.704 -0.68 . . . . 0.0 110.296 171.024 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 29.7 mmmt -74.8 87.92 2.26 Favored 'General case' 0 C--N 1.36 1.051 0 C-N-CA 123.781 0.833 . . . . 0.0 110.711 -179.468 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . 0.592 HD11 ' HA3' ' A' ' 40' ' ' GLY . 19.7 pt -137.17 -163.83 0.32 Allowed 'Isoleucine or valine' 0 N--CA 1.475 0.82 0 C-N-CA 124.595 1.158 . . . . 0.0 108.458 175.784 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . 0.652 ' HB2' ' HG2' ' A' ' 39' ' ' MET . 7.8 m-20 -51.69 124.92 27.72 Favored Pre-proline 0 N--CA 1.476 0.86 0 CA-C-O 118.624 -0.703 . . . . 0.0 110.23 175.371 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 26.9 Cg_endo -58.4 -16.45 29.11 Favored 'Trans proline' 0 C--N 1.38 2.221 0 C-N-CA 123.256 2.638 . . . . 0.0 112.983 -178.317 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 42.8 mm -71.05 -49.57 48.33 Favored 'Isoleucine or valine' 0 CA--C 1.548 0.873 0 C-N-CA 124.807 1.243 . . . . 0.0 111.275 176.114 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . 0.652 ' HG2' ' HB2' ' A' ' 36' ' ' ASP . 27.3 ptm -110.37 153.28 25.17 Favored 'General case' 0 N--CA 1.485 1.286 0 N-CA-C 112.515 0.561 . . . . 0.0 112.515 -169.166 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . 0.592 ' HA3' HD11 ' A' ' 35' ' ' ILE . . . 84.71 -11.18 60.09 Favored Glycine 0 C--N 1.351 1.404 0 N-CA-C 115.068 0.787 . . . . 0.0 115.068 169.791 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 97.7 m-85 -91.47 6.1 46.85 Favored 'General case' 0 N--CA 1.481 1.111 0 CA-C-N 117.336 0.568 . . . . 0.0 111.538 179.306 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . . . . . . . . . 26.2 p -66.75 159.92 26.89 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.483 0.713 . . . . 0.0 110.907 170.738 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 14.5 t -58.33 -40.08 81.18 Favored 'General case' 0 N--CA 1.475 0.812 0 C-N-CA 123.716 0.806 . . . . 0.0 110.972 -179.337 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 60.3 p -93.78 86.91 5.25 Favored 'General case' 0 CA--C 1.549 0.918 0 N-CA-C 109.268 -0.641 . . . . 0.0 109.268 172.415 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 53.9 p -101.18 130.18 47.23 Favored 'General case' 0 C--O 1.243 0.754 0 C-N-CA 123.74 0.816 . . . . 0.0 109.823 176.733 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . . . . . . . . . 38.8 t0 -86.62 135.73 33.31 Favored 'General case' 0 C--O 1.241 0.618 0 N-CA-C 108.611 -0.885 . . . . 0.0 108.611 177.264 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 1.7 mpt? -71.61 -175.37 1.32 Allowed 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 123.479 0.712 . . . . 0.0 111.568 -176.756 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.631 ' HA ' HG13 ' A' ' 31' ' ' VAL . 0.0 OUTLIER -61.04 143.72 54.83 Favored 'General case' 0 C--O 1.242 0.66 0 CA-C-N 116.111 -0.495 . . . . 0.0 111.267 178.741 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 10.0 pt20 -155.14 177.56 11.2 Favored 'General case' 0 N--CA 1.472 0.637 0 C-N-CA 123.651 0.78 . . . . 0.0 110.255 -169.433 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . 0.484 ' HA ' ' O ' ' A' ' 27' ' ' PHE . 25.3 mp0 -85.41 103.06 13.96 Favored 'General case' 0 C--O 1.239 0.541 0 C-N-CA 122.874 0.47 . . . . 0.0 110.291 -179.281 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . 0.528 HG22 ' HB2' ' A' ' 29' ' ' ALA . 16.6 m -100.21 168.79 1.77 Allowed 'Isoleucine or valine' 0 N--CA 1.474 0.744 0 N-CA-C 108.609 -0.885 . . . . 0.0 108.609 172.188 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.553 ' HE3' ' SD ' ' A' ' 13' ' ' MET . 23.5 pttm -144.14 148.33 34.91 Favored 'General case' 0 N--CA 1.475 0.81 0 CA-C-O 121.93 0.871 . . . . 0.0 113.263 -167.569 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 10.7 mp -120.99 155.65 33.83 Favored 'General case' 0 N--CA 1.474 0.757 0 CA-C-N 113.85 -1.523 . . . . 0.0 107.855 179.741 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 23.2 p -118.15 130.66 56.24 Favored 'General case' 0 CA--C 1.547 0.844 0 C-N-CA 123.348 0.659 . . . . 0.0 110.252 179.371 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 89.4 m-85 -129.75 153.05 48.59 Favored 'General case' 0 N--CA 1.475 0.785 0 C-N-CA 125.358 1.463 . . . . 0.0 109.206 -175.334 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.432 ' HB2' HE22 ' A' ' 60' ' ' GLN . 14.7 mm-40 -72.01 -29.86 64.63 Favored 'General case' 0 N--CA 1.474 0.767 0 C-N-CA 123.187 0.595 . . . . 0.0 111.745 -179.062 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 66.9 p -136.44 163.42 30.52 Favored 'General case' 0 N--CA 1.486 1.36 0 C-N-CA 123.431 0.692 . . . . 0.0 110.758 -179.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 38.8 tt0 -57.5 -44.58 85.12 Favored 'General case' 0 N--CA 1.48 1.069 0 C-N-CA 123.796 0.838 . . . . 0.0 110.615 172.162 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . 0.514 ' HA ' ' HG2' ' A' ' 62' ' ' GLU . 41.8 mt-10 -56.61 -39.09 72.99 Favored 'General case' 0 CA--C 1.536 0.407 0 O-C-N 124.677 1.235 . . . . 0.0 111.969 -174.919 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.432 HE22 ' HB2' ' A' ' 56' ' ' GLU . 78.6 mt-30 -64.04 -39.66 94.57 Favored 'General case' 0 CA--C 1.548 0.894 0 C-N-CA 123.484 0.714 . . . . 0.0 111.541 175.096 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -74.4 -40.05 62.27 Favored 'General case' 0 N--CA 1.48 1.037 0 C-N-CA 123.302 0.641 . . . . 0.0 111.768 -177.688 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . 0.514 ' HG2' ' HA ' ' A' ' 59' ' ' GLU . 10.7 pt-20 -76.82 -43.01 38.18 Favored 'General case' 0 C--O 1.219 -0.525 0 CA-C-N 115.595 -0.729 . . . . 0.0 111.135 -173.699 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -68.99 -27.21 65.49 Favored 'General case' 0 C--N 1.347 0.494 0 C-N-CA 123.168 0.587 . . . . 0.0 111.431 178.744 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 87.8 t80 -64.21 -54.31 35.48 Favored 'General case' 0 C--N 1.354 0.804 0 N-CA-C 108.414 -0.958 . . . . 0.0 108.414 172.694 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -55.33 -48.41 74.22 Favored 'General case' 0 CA--C 1.553 1.069 0 C-N-CA 124.586 1.154 . . . . 0.0 111.833 178.191 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.3 mt-30 -60.7 -43.9 97.21 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 124.421 1.088 . . . . 0.0 111.432 -179.072 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 67.8 ttt180 -64.0 -28.1 69.58 Favored 'General case' 0 N--CA 1.481 1.095 0 C-N-CA 124.587 1.155 . . . . 0.0 111.552 179.266 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 75.0 mmtt -93.87 -13.53 27.1 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 123.264 0.626 . . . . 0.0 111.116 177.622 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 89.02 -1.12 82.8 Favored Glycine 0 C--N 1.354 1.529 0 O-C-N 123.332 0.395 . . . . 0.0 113.252 -176.349 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 61.8 mt -63.17 110.67 0.81 Allowed 'Isoleucine or valine' 0 CA--C 1.559 1.294 0 CA-C-O 121.836 0.827 . . . . 0.0 110.807 179.268 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 11.4 pt-20 -65.68 137.28 57.21 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-N 113.352 -1.749 . . . . 0.0 109.137 171.595 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 44.7 p90 -140.44 149.76 42.98 Favored 'General case' 0 N--CA 1.489 1.481 0 CA-C-N 118.669 0.668 . . . . 0.0 112.486 -169.858 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 5.5 mmp_? -108.52 111.59 23.53 Favored 'General case' 0 N--CA 1.479 1.019 0 C-N-CA 124.164 0.986 . . . . 0.0 109.5 175.017 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . . . . . . . . . 76.7 t -79.64 118.22 26.77 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.928 0 C-N-CA 123.477 0.711 . . . . 0.0 109.819 178.933 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 27.6 mt -122.86 97.48 4.82 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.634 0 C-N-CA 125.438 1.495 . . . . 0.0 107.495 -179.73 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . 0.4 ' HB3' ' HB3' ' A' ' 80' ' ' ALA . 62.8 mt -68.38 146.39 97.84 Favored Pre-proline 0 CA--C 1.554 1.109 0 C-N-CA 123.264 0.626 . . . . 0.0 112.386 -173.831 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.533 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 72.9 Cg_endo -73.28 177.92 7.27 Favored 'Trans proline' 0 C--N 1.376 2.005 0 C-N-CA 123.312 2.675 . . . . 0.0 113.487 -179.394 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 1.3 pptp? -65.27 -23.44 67.04 Favored 'General case' 0 N--CA 1.482 1.143 0 N-CA-C 114.241 1.2 . . . . 0.0 114.241 -169.823 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 1.7 pm0 -99.6 -12.11 20.37 Favored 'General case' 0 N--CA 1.487 1.38 0 C-N-CA 122.568 0.347 . . . . 0.0 111.731 -179.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . 0.4 ' HB3' ' HB3' ' A' ' 76' ' ' LEU . . . . . . . . 0 N--CA 1.484 1.26 0 C-N-CA 122.844 0.457 . . . . 0.0 111.708 -178.203 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.476 0.867 0 N-CA-C 109.674 -0.491 . . . . 0.0 109.674 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' SER . . . . . . . . . . . . . 20.3 m -121.06 121.34 37.7 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 123.827 0.851 . . . . 0.0 109.078 -177.151 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' ALA . . . . . 0.487 ' HA ' ' HB3' ' A' ' 27' ' ' PHE . . . -101.28 128.84 47.24 Favored 'General case' 0 N--CA 1.471 0.6 0 C-N-CA 123.234 0.614 . . . . 0.0 109.998 -174.806 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' LYS . . . . . . . . . . . . . 60.9 pttt -109.04 123.79 49.7 Favored 'General case' 0 C--O 1.238 0.497 0 N-CA-C 107.201 -1.407 . . . . 0.0 107.201 176.698 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' ILE . . . . . 0.544 ' HB ' HG12 ' A' ' 74' ' ' VAL . 4.7 mp -109.17 121.14 61.77 Favored 'Isoleucine or valine' 0 C--O 1.221 -0.433 0 N-CA-C 106.054 -1.832 . . . . 0.0 106.054 179.04 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' TYR . . . . . . . . . . . . . 30.3 p90 -148.42 170.87 17.05 Favored 'General case' 0 C--N 1.313 -1.015 0 N-CA-C 108.061 -1.089 . . . . 0.0 108.061 -172.911 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' ARG . . . . . 0.749 ' HB3' ' HB3' ' A' ' 77' ' ' PRO . 58.0 ttt180 -139.36 96.3 8.86 Favored Pre-proline 0 C--N 1.316 -0.87 0 N-CA-C 107.398 -1.334 . . . . 0.0 107.398 177.32 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' PRO . . . . . . . . . . . . . 59.2 Cg_endo -73.72 167.0 28.34 Favored 'Trans proline' 0 C--N 1.371 1.76 0 C-N-CA 122.488 2.125 . . . . 0.0 112.023 -173.351 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' ALA . . . . . . . . . . . . . . . -70.66 -39.3 73.69 Favored 'General case' 0 N--CA 1.476 0.857 0 C-N-CA 122.752 0.421 . . . . 0.0 109.986 175.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' LYS . . . . . . . . . . . . . 17.4 ptpt -86.8 146.56 26.19 Favored 'General case' 0 N--CA 1.47 0.564 0 CA-C-N 115.429 -0.805 . . . . 0.0 110.289 173.792 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' THR . . . . . . . . . . . . . 1.4 p -160.17 -172.76 3.73 Favored 'General case' 0 N--CA 1.484 1.259 0 C-N-CA 125.003 1.321 . . . . 0.0 108.741 179.32 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -78.31 -179.83 6.5 Favored 'General case' 0 CA--C 1.549 0.928 0 C-N-CA 122.705 0.402 . . . . 0.0 110.113 169.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' MET . . . . . . . . . . . . . 66.3 mtm -89.73 -177.61 5.31 Favored 'General case' 0 N--CA 1.479 0.986 0 C-N-CA 123.598 0.759 . . . . 0.0 111.599 -175.869 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' GLN . . . . . . . . . . . . . 84.2 mt-30 -67.5 110.99 3.87 Favored 'General case' 0 N--CA 1.474 0.768 0 N-CA-C 109.312 -0.625 . . . . 0.0 109.312 175.428 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' SER . . . . . . . . . . . . . 36.6 p -160.48 176.5 11.56 Favored 'General case' 0 C--O 1.24 0.59 0 C-N-CA 122.814 0.446 . . . . 0.0 110.953 -171.305 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' GLY . . . . . . . . . . . . . . . -74.79 -23.0 76.11 Favored Glycine 0 C--N 1.345 1.063 0 CA-C-N 115.56 -0.745 . . . . 0.0 112.13 172.761 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' THR . . . . . . . . . . . . . 14.9 t -84.99 -25.3 27.82 Favored 'General case' 0 CA--C 1.551 0.982 0 C-N-CA 123.454 0.702 . . . . 0.0 111.648 178.973 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' ALA . . . . . . . . . . . . . . . -142.78 128.9 19.73 Favored 'General case' 0 N--CA 1.487 1.385 0 C-N-CA 122.907 0.483 . . . . 0.0 111.656 -177.819 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' LYS . . . . . . . . . . . . . 26.2 mmtp -83.71 57.39 4.07 Favored 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.257 1.023 . . . . 0.0 109.812 176.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' THR . . . . . . . . . . . . . 43.3 m 67.76 -69.85 0.13 Allowed 'General case' 0 CA--C 1.559 1.318 0 C-N-CA 125.301 1.441 . . . . 0.0 112.173 179.991 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' ASN . . . . . . . . . . . . . 19.0 t-20 -142.79 115.74 8.8 Favored 'General case' 0 N--CA 1.484 1.241 0 N-CA-C 109.063 -0.717 . . . . 0.0 109.063 176.377 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' VAL . . . . . . . . . . . . . 15.3 m -132.68 -177.25 2.02 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.057 0 C-N-CA 124.005 0.922 . . . . 0.0 110.614 -177.235 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' TRP . . . . . . . . . . . . . 66.4 m95 -88.79 129.1 35.63 Favored 'General case' 0 CA--C 1.538 0.498 0 C-N-CA 124.414 1.085 . . . . 0.0 108.86 -175.288 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' VAL . . . . . . . . . . . . . 39.0 t -101.35 137.28 29.52 Favored 'Isoleucine or valine' 0 CA--C 1.537 0.478 0 N-CA-C 108.576 -0.898 . . . . 0.0 108.576 175.179 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.429 HD21 ' HB1' ' A' ' 3' ' ' ALA . 5.6 tt -112.45 108.56 17.74 Favored 'General case' 0 C--O 1.221 -0.411 0 N-CA-C 105.359 -2.089 . . . . 0.0 105.359 175.017 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLU . . . . . . . . . . . . . 33.5 tt0 -114.14 132.7 55.98 Favored 'General case' 0 C--N 1.321 -0.651 0 N-CA-C 107.566 -1.272 . . . . 0.0 107.566 177.876 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' PHE . . . . . 0.487 ' HB3' ' HA ' ' A' ' 3' ' ' ALA . 3.3 p90 -144.79 157.77 44.04 Favored 'General case' 0 C--O 1.241 0.643 0 CA-C-O 121.555 0.693 . . . . 0.0 112.615 -178.318 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' ASP . . . . . . . . . . . . . 8.2 t70 -59.54 110.43 1.12 Allowed 'General case' 0 CA--C 1.534 0.349 0 N-CA-C 106.166 -1.79 . . . . 0.0 106.166 160.535 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' ALA . . . . . . . . . . . . . . . -56.49 143.13 36.32 Favored 'General case' 0 N--CA 1.471 0.617 0 N-CA-C 113.549 0.944 . . . . 0.0 113.549 -168.31 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 12.6 pt-20 -78.26 11.82 2.19 Favored 'General case' 0 N--CA 1.482 1.13 0 CA-C-N 114.613 -1.176 . . . . 0.0 111.557 176.829 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' VAL . . . . . . . . . . . . . 7.4 p -153.1 140.14 12.94 Favored Pre-proline 0 CA--C 1.555 1.141 0 C-N-CA 124.49 1.116 . . . . 0.0 108.41 -173.192 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' PRO . . . . . 0.472 ' HA ' ' HA ' ' A' ' 48' ' ' LYS . 74.4 Cg_endo -72.25 -174.46 1.41 Allowed 'Trans proline' 0 C--N 1.375 1.959 0 C-N-CA 122.223 1.948 . . . . 0.0 111.589 169.297 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' ARG . . . . . 0.539 ' HG3' ' HA ' ' A' ' 42' ' ' THR . 0.0 OUTLIER -62.14 -28.6 69.76 Favored 'General case' 0 N--CA 1.48 1.027 0 CA-C-O 121.482 0.658 . . . . 0.0 109.985 167.618 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' LYS . . . . . . . . . . . . . 27.3 tptp -81.89 95.22 7.28 Favored 'General case' 0 C--N 1.35 0.618 0 CA-C-N 114.805 -1.089 . . . . 0.0 110.801 -170.613 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' ILE . . . . . . . . . . . . . 12.7 pt -98.92 -100.86 0.06 OUTLIER 'Isoleucine or valine' 0 CA--C 1.552 1.035 0 N-CA-C 106.125 -1.805 . . . . 0.0 106.125 161.12 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' ASP . . . . . . . . . . . . . 20.1 m-20 -75.6 158.24 83.35 Favored Pre-proline 0 CA--C 1.55 0.953 0 N-CA-C 108.704 -0.851 . . . . 0.0 108.704 154.752 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' PRO . . . . . . . . . . . . . 42.4 Cg_endo -64.11 -4.64 8.0 Favored 'Trans proline' 0 C--N 1.377 2.074 0 C-N-CA 122.557 2.171 . . . . 0.0 113.81 176.775 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ILE . . . . . . . . . . . . . 48.5 mm -54.34 -36.52 34.04 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.166 0 C-N-CA 125.107 1.363 . . . . 0.0 112.194 177.046 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' MET . . . . . . . . . . . . . 80.8 mtp -82.37 63.38 6.52 Favored 'General case' 0 N--CA 1.486 1.356 0 CA-C-O 121.565 0.697 . . . . 0.0 111.703 178.532 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' GLY . . . . . . . . . . . . . . . 64.62 10.37 43.56 Favored Glycine 0 C--N 1.352 1.42 0 CA-C-N 114.722 -1.126 . . . . 0.0 115.595 171.371 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' TYR . . . . . . . . . . . . . 24.0 m-85 61.64 -73.65 0.03 OUTLIER 'General case' 0 N--CA 1.487 1.386 0 C-N-CA 124.888 1.275 . . . . 0.0 110.143 -171.224 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' THR . . . . . 0.539 ' HA ' ' HG3' ' A' ' 33' ' ' ARG . 8.1 t -152.01 117.5 5.34 Favored 'General case' 0 CA--C 1.547 0.842 0 C-N-CA 124.391 1.077 . . . . 0.0 109.539 170.046 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' SER . . . . . . . . . . . . . 20.2 m -73.89 -49.11 26.41 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 123.541 0.736 . . . . 0.0 111.454 -176.432 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' SER . . . . . . . . . . . . . 21.6 t -151.77 50.19 0.8 Allowed 'General case' 0 CA--C 1.549 0.93 0 C-N-CA 123.264 0.625 . . . . 0.0 110.512 -176.381 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' SER . . . . . . . . . . . . . 28.5 m 56.32 53.43 8.8 Favored 'General case' 0 N--CA 1.485 1.31 0 C-N-CA 124.074 0.949 . . . . 0.0 110.413 178.331 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ASP . . . . . 0.41 ' HB2' ' HD2' ' A' ' 33' ' ' ARG . 0.1 OUTLIER -86.96 83.76 7.45 Favored 'General case' 0 N--CA 1.468 0.463 0 CA-C-N 114.671 -1.15 . . . . 0.0 109.503 -167.916 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' MET . . . . . . . . . . . . . 55.6 tpp -58.61 -31.57 68.21 Favored 'General case' 0 N--CA 1.487 1.392 0 CA-C-O 121.429 0.633 . . . . 0.0 109.953 175.263 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.472 ' HA ' ' HA ' ' A' ' 32' ' ' PRO . 0.0 OUTLIER -145.19 157.48 44.07 Favored 'General case' 0 CA--C 1.54 0.571 0 CA-C-N 114.686 -1.143 . . . . 0.0 108.132 166.515 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' GLN . . . . . . . . . . . . . 12.3 pt20 -100.75 -161.01 0.83 Allowed 'General case' 0 N--CA 1.476 0.861 0 N-CA-C 108.426 -0.953 . . . . 0.0 108.426 170.832 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLN . . . . . . . . . . . . . 1.2 pp0? -119.85 144.92 47.1 Favored 'General case' 0 N--CA 1.476 0.849 0 N-CA-C 108.705 -0.85 . . . . 0.0 108.705 168.238 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' VAL . . . . . . . . . . . . . 99.2 t -134.72 146.53 30.63 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.969 0 N-CA-C 108.982 -0.747 . . . . 0.0 108.982 177.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' LYS . . . . . 0.407 ' HA ' ' O ' ' A' ' 25' ' ' LEU . 6.5 ptpp? -138.8 134.48 33.46 Favored 'General case' 0 N--CA 1.467 0.389 0 CA-C-N 115.487 -0.779 . . . . 0.0 111.331 172.917 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' LEU . . . . . . . . . . . . . 0.7 OUTLIER -113.24 159.88 18.87 Favored 'General case' 0 CA--C 1.54 0.586 0 C-N-CA 124.952 1.301 . . . . 0.0 107.749 175.933 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' THR . . . . . . . . . . . . . 16.1 p -125.82 129.82 50.16 Favored 'General case' 0 N--CA 1.471 0.621 0 CA-C-O 121.17 0.509 . . . . 0.0 110.118 170.417 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' PHE . . . . . . . . . . . . . 91.4 m-85 -127.04 150.36 49.48 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 125.547 1.539 . . . . 0.0 108.734 179.984 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' GLU . . . . . 0.421 ' HB2' HE22 ' A' ' 60' ' ' GLN . 43.8 mt-10 -72.43 -26.15 61.74 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 123.412 0.685 . . . . 0.0 111.763 -176.647 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' THR . . . . . . . . . . . . . 68.1 p -130.34 159.78 35.93 Favored 'General case' 0 C--O 1.246 0.905 0 C-N-CA 123.453 0.701 . . . . 0.0 109.619 178.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' GLN . . . . . . . . . . . . . 23.6 tt0 -62.71 -39.26 93.47 Favored 'General case' 0 N--CA 1.467 0.387 0 CA-C-N 115.836 -0.62 . . . . 0.0 110.495 171.423 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' GLU . . . . . . . . . . . . . 3.1 mp0 -55.33 -41.12 72.02 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 124.367 1.042 . . . . 0.0 111.874 -176.077 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' GLN . . . . . 0.421 HE22 ' HB2' ' A' ' 56' ' ' GLU . 48.9 mt-30 -68.21 -32.78 73.24 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.099 0.56 . . . . 0.0 111.395 179.349 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' ALA . . . . . . . . . . . . . . . -81.45 -41.44 21.82 Favored 'General case' 0 N--CA 1.474 0.747 0 C-N-CA 123.506 0.723 . . . . 0.0 111.326 -175.934 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' GLU . . . . . . . . . . . . . 10.4 pt-20 -70.39 -38.91 74.76 Favored 'General case' 0 C--O 1.222 -0.351 0 CA-C-N 115.495 -0.775 . . . . 0.0 109.843 178.678 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' ALA . . . . . . . . . . . . . . . -62.31 -30.36 71.09 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.159 0.584 . . . . 0.0 112.078 175.058 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' TYR . . . . . . . . . . . . . 74.4 t80 -63.33 -59.15 5.09 Favored 'General case' 0 N--CA 1.483 1.177 0 N-CA-C 109.483 -0.562 . . . . 0.0 109.483 173.539 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' ALA . . . . . . . . . . . . . . . -54.95 -43.73 73.7 Favored 'General case' 0 CA--C 1.549 0.912 0 C-N-CA 124.12 0.968 . . . . 0.0 111.662 179.841 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' GLN . . . . . . . . . . . . . 47.7 mt-30 -65.86 -42.65 90.16 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 124.178 0.991 . . . . 0.0 111.799 -179.451 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' ARG . . . . . . . . . . . . . 47.0 ttt180 -55.66 -38.34 69.46 Favored 'General case' 0 N--CA 1.484 1.23 0 C-N-CA 124.566 1.146 . . . . 0.0 110.684 173.641 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' LYS . . . . . . . . . . . . . 71.6 mmtt -80.77 -26.41 37.27 Favored 'General case' 0 N--CA 1.472 0.665 0 C-N-CA 123.823 0.849 . . . . 0.0 110.754 -179.314 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' GLY . . . . . . . . . . . . . . . 94.86 -5.26 69.07 Favored Glycine 0 C--N 1.349 1.301 0 CA-C-O 119.721 -0.488 . . . . 0.0 112.541 -169.741 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ILE . . . . . . . . . . . . . 76.6 mt -59.68 112.13 0.63 Allowed 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 CA-C-O 121.437 0.637 . . . . 0.0 110.644 -178.09 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 -52.95 135.34 36.82 Favored 'General case' 0 N--CA 1.484 1.259 0 CA-C-N 113.149 -1.841 . . . . 0.0 108.821 170.059 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TYR . . . . . . . . . . . . . 28.5 p90 -143.04 145.93 33.36 Favored 'General case' 0 CA--C 1.539 0.521 0 CA-C-N 118.428 0.558 . . . . 0.0 111.207 -170.627 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' ARG . . . . . . . . . . . . . 3.4 tmt_? -125.64 114.01 18.14 Favored 'General case' 0 N--CA 1.472 0.66 0 N-CA-C 107.706 -1.22 . . . . 0.0 107.706 175.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' VAL . . . . . 0.544 HG12 ' HB ' ' A' ' 5' ' ' ILE . 24.5 m -84.53 139.99 16.73 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.02 0 C-N-CA 122.92 0.488 . . . . 0.0 111.077 177.522 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' ILE . . . . . . . . . . . . . 3.9 mp -115.83 126.29 73.29 Favored 'Isoleucine or valine' 0 CA--C 1.541 0.63 0 C-N-CA 125.469 1.508 . . . . 0.0 107.412 176.21 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' LEU . . . . . . . . . . . . . 62.8 mt -69.14 144.01 94.76 Favored Pre-proline 0 CA--C 1.551 0.983 0 C-N-CA 122.927 0.491 . . . . 0.0 110.535 177.943 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' PRO . . . . . 0.749 ' HB3' ' HB3' ' A' ' 7' ' ' ARG . 81.7 Cg_endo -79.08 177.05 9.11 Favored 'Trans proline' 0 C--N 1.366 1.453 0 C-N-CA 122.84 2.36 . . . . 0.0 112.901 -179.88 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' LYS . . . . . . . . . . . . . 0.0 OUTLIER -66.54 -16.66 64.32 Favored 'General case' 0 N--CA 1.482 1.133 0 CA-C-N 115.495 -0.775 . . . . 0.0 110.537 172.355 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' GLU . . . . . . . . . . . . . 16.7 pt-20 -112.34 41.35 2.02 Favored 'General case' 0 CA--C 1.553 1.095 0 C-N-CA 125.292 1.437 . . . . 0.0 109.316 178.564 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' ALA . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.485 1.31 0 O-C-N 121.534 -0.729 . . . . 0.0 112.759 -176.674 . . . . . . . . 0 0 . 1 stop_ save_