data_2lnb_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 2lnb _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 ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 N--CA 1.477 0.906 0 CA-C-O 119.475 -0.298 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 001 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -62.93 -44.44 97.4 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-O 119.446 -0.641 . . . . 0.0 112.855 171.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -66.87 -42.9 84.85 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.51 0.671 . . . . 0.0 109.745 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.424 HD11 HD23 ' A' ' 51' ' ' LEU . 2.0 tm? -62.42 -41.41 98.68 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.609 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.487 ' HG3' ' HE1' ' A' ' 58' ' ' MET . 34.7 tt0 -64.42 -42.82 95.84 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.673 0.789 . . . . 0.0 110.33 178.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 99.3 mt-30 -62.31 -36.25 81.57 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.06 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.502 ' O ' HG23 ' A' ' 27' ' ' VAL . 34.9 mmm-85 -64.84 -50.66 65.77 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 123.702 0.626 . . . . 0.0 110.852 175.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 80.2 mt -56.63 -50.39 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 124.141 0.9 . . . . 0.0 109.864 -176.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.533 HD23 ' HB3' ' A' ' 63' ' ' LYS . 96.1 mt -61.69 -37.84 85.62 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.594 0.758 . . . . 0.0 111.274 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -69.58 -44.47 70.75 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.016 0.926 . . . . 0.0 110.517 -176.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 23' ' ' ARG . 94.4 t -60.1 -43.12 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.95 0.9 . . . . 0.0 110.241 176.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.453 HD22 ' HA ' ' A' ' 73' ' ' CYS . 80.6 mt -64.48 -34.96 79.42 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.853 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.6 m -74.52 -43.15 57.25 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 123.644 0.778 . . . . 0.0 111.283 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -62.67 -41.57 99.15 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.451 0.7 . . . . 0.0 110.361 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -41.91 92.6 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.976 0.798 . . . . 0.0 110.417 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 63.62 27.61 71.24 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.464 -170.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.9 m -159.16 161.74 27.28 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.016 1.326 . . . . 0.0 109.611 -166.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -53.84 125.85 20.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 122.802 2.335 . . . . 0.0 113.473 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.444 HG23 HG12 ' A' ' 27' ' ' VAL . 76.8 t -107.37 130.45 59.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.18 0.992 . . . . 0.0 108.392 174.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.32 151.59 47.2 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.639 0.776 . . . . 0.0 110.499 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.5 tp -63.04 -49.01 76.24 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.969 0.907 . . . . 0.0 110.425 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -50.09 -37.6 34.59 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.822 0.849 . . . . 0.0 112.333 170.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.423 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 46.3 tt0 -73.95 -36.38 64.62 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.88 -31.51 72.56 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.272 0.629 . . . . 0.0 110.393 178.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.512 ' HA ' HD11 ' A' ' 51' ' ' LEU . 45.4 t -57.85 -54.03 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 O-C-N 123.573 0.546 . . . . 0.0 110.717 174.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HE3' ' HG3' ' A' ' 39' ' ' GLN . 20.6 pttp -75.13 -39.21 60.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.499 -173.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -65.39 -58.21 6.44 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.42 0.688 . . . . 0.0 111.87 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 37.6 m -80.97 -4.36 54.79 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.817 0.447 . . . . 0.0 111.252 -173.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 62.08 31.25 17.91 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.12 1.368 . . . . 0.0 111.597 171.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -128.47 150.06 73.41 Favored Pre-proline 0 N--CA 1.476 0.873 0 C-N-CA 123.52 0.728 . . . . 0.0 110.344 -175.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.2 142.07 71.99 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.458 2.106 . . . . 0.0 111.757 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -43.46 -41.3 4.24 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.769 1.228 . . . . 0.0 112.051 172.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -54.09 -51.69 63.36 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.362 1.065 . . . . 0.0 111.625 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -66.49 -44.9 81.36 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.568 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.512 HD11 ' HA ' ' A' ' 41' ' ' VAL . 98.5 mt -54.75 -51.17 66.52 Favored 'General case' 0 C--O 1.212 -0.879 0 O-C-N 124.43 1.081 . . . . 0.0 111.253 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -48.74 -56.75 7.73 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.087 0.955 . . . . 0.0 112.194 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -58.93 -41.89 88.46 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 123.997 0.81 . . . . 0.0 112.115 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.48 HG12 HH21 ' A' ' 57' ' ' ARG . 86.1 t -68.95 -48.31 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 122.987 0.515 . . . . 0.0 110.259 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -55.59 -38.29 69.2 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.563 1.545 . . . . 0.0 114.178 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -70.41 -30.78 67.75 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 118.767 0.712 . . . . 0.0 110.792 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.48 HH21 HG12 ' A' ' 54' ' ' VAL . 46.5 ttp180 -71.42 -44.23 65.26 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.858 0.724 . . . . 0.0 109.348 176.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.487 ' HE1' ' HG3' ' A' ' 21' ' ' GLU . 80.5 mtp -63.55 -31.98 73.3 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.335 1.054 . . . . 0.0 111.046 176.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.52 -44.92 95.17 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.708 0.803 . . . . 0.0 110.611 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 57' ' ' ARG . 52.7 mttm -63.02 -35.9 81.77 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.623 0.769 . . . . 0.0 110.749 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -85.88 5.25 33.74 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.555 0.742 . . . . 0.0 111.312 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.8 mt 66.36 9.95 6.84 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 125.218 1.407 . . . . 0.0 113.016 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.533 ' HB3' HD23 ' A' ' 25' ' ' LEU . 94.2 mttt -69.11 -35.34 76.32 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.372 1.069 . . . . 0.0 111.094 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.475 HG11 ' HE2' ' A' ' 58' ' ' MET . 30.5 m -129.8 158.67 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.613 0.765 . . . . 0.0 109.919 177.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.1 m -132.92 152.85 51.83 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.421 1.089 . . . . 0.0 108.075 172.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.96 112.77 24.58 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.1 p -87.58 -37.72 16.59 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.12 0.568 . . . . 0.0 111.553 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.639 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 9.2 t -140.59 155.09 69.75 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -176.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -26.18 -68.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.391 2.799 0 C-N-CA 125.071 3.847 . . . . 0.0 116.495 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.22 41.35 2.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.186 0.594 . . . . 0.0 110.902 176.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.639 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 26.5 m -129.37 125.71 37.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.641 0.776 . . . . 0.0 108.955 174.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -108.27 163.83 12.85 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.802 0.841 . . . . 0.0 109.219 -175.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.453 ' HA ' HD22 ' A' ' 28' ' ' LEU . 43.9 t -146.3 164.02 33.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 177.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 35.2 tp -68.35 135.38 51.75 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.415 -0.958 . . . . 0.0 108.415 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 1.393 0 O-C-N 124.174 0.922 . . . . 0.0 111.608 179.348 . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 119.661 -0.209 . . . . 0.0 111.524 . . . . . . . . . 0 0 . 1 . 002 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.42 -52.76 47.97 Favored Glycine 0 C--N 1.346 1.134 0 N-CA-C 114.371 0.508 . . . . 0.0 114.371 171.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -67.27 -36.04 80.76 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.961 0.504 . . . . 0.0 110.155 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.419 ' O ' HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -64.37 -51.88 61.08 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.123 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.29 -47.43 79.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.96 0.904 . . . . 0.0 111.108 -175.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -38.11 85.7 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 124.067 0.854 . . . . 0.0 110.739 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.403 ' O ' HG23 ' A' ' 27' ' ' VAL . 14.1 tpp180 -71.83 -38.51 70.15 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 122.986 0.514 . . . . 0.0 110.857 -178.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 20' ' ' LEU . 82.5 mt -58.76 -51.76 68.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 122.806 0.443 . . . . 0.0 109.934 174.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.6 mt -56.1 -43.15 77.82 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 123.672 0.789 . . . . 0.0 110.905 178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -61.64 -51.18 69.51 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 124.194 0.934 . . . . 0.0 111.12 -175.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 23' ' ' ARG . 87.7 t -57.82 -41.97 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 124.133 0.896 . . . . 0.0 110.971 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.05 -33.11 71.53 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.252 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.6 m -71.64 -49.43 40.08 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 123.432 0.693 . . . . 0.0 112.12 177.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.51 -36.46 82.64 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.21 0.604 . . . . 0.0 110.268 -176.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.62 -38.35 70.81 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.815 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.52 22.98 64.33 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 124.031 0.832 . . . . 0.0 113.342 -176.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.6 m -152.62 164.88 18.89 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.149 0.98 . . . . 0.0 109.724 -167.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -58.93 117.09 3.76 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 122.364 2.043 . . . . 0.0 112.509 172.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.4 t -111.31 133.2 57.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.625 1.17 . . . . 0.0 108.573 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 59.4 mtpt -68.77 144.58 54.29 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.347 0.659 . . . . 0.0 109.875 177.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.473 HD13 HD11 ' A' ' 55' ' ' LEU . 29.1 tp -58.48 -40.44 82.74 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.721 0.638 . . . . 0.0 110.808 176.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.02 -44.83 2.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.418 1.087 . . . . 0.0 113.16 167.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -81.66 -32.61 31.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.346 0.258 . . . . 0.0 110.536 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.3 mt -58.62 -33.52 70.13 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.666 0.387 . . . . 0.0 110.194 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 37' ' ' LEU . 99.0 t -52.8 -58.8 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.78 0.832 . . . . 0.0 112.285 173.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -70.5 -40.96 73.27 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -69.33 -43.58 73.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 82.0 m -77.77 -15.47 59.08 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 61.28 26.15 16.03 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.786 0.835 . . . . 0.0 110.296 -173.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.91 143.75 31.4 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 124.124 0.969 . . . . 0.0 110.081 -171.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.66 138.32 41.23 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.583 2.189 . . . . 0.0 111.615 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -47.99 -30.3 4.19 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.218 1.407 . . . . 0.0 112.721 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 mtm180 -56.45 -56.69 18.01 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.143 0.977 . . . . 0.0 111.136 174.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -66.23 -43.01 87.82 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.21 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.7 mt -54.74 -52.9 61.07 Favored 'General case' 0 C--O 1.209 -1.048 0 O-C-N 124.448 1.093 . . . . 0.0 110.098 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -47.53 -58.9 3.67 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.283 1.033 . . . . 0.0 112.08 176.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -53.51 -50.88 64.48 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.226 1.01 . . . . 0.0 112.339 -177.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.29 -43.68 84.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 C-N-CA 123.147 0.579 . . . . 0.0 111.462 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.473 HD11 HD13 ' A' ' 37' ' ' LEU . 27.8 mt -48.19 -48.5 34.66 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.992 1.317 . . . . 0.0 114.265 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -72.48 -25.62 61.49 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.392 0.996 . . . . 0.0 111.86 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -70.31 -55.34 9.42 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.451 ' HB2' ' HB2' ' A' ' 63' ' ' LYS . 18.0 ptm -67.99 -23.85 65.07 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.922 -178.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.2 tttm -69.15 -43.1 74.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.608 0.763 . . . . 0.0 110.72 171.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.517 ' HB2' ' HZ3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -59.19 -37.88 78.48 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.98 0.912 . . . . 0.0 110.577 175.298 . . . . . . . . 3 3 . 1 . 002 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -86.21 -0.49 55.87 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 115.056 -0.975 . . . . 0.0 112.038 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.3 mt 60.8 24.72 14.62 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.068 1.347 . . . . 0.0 112.688 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.451 ' HB2' ' HB2' ' A' ' 58' ' ' MET . 55.1 mttm -67.5 -32.13 72.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.505 1.122 . . . . 0.0 109.569 168.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.447 HG22 ' HG3' ' A' ' 58' ' ' MET . 28.1 m -133.37 160.79 42.17 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.558 171.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.1 m -129.85 156.46 44.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 171.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.4 tp -103.07 112.4 25.22 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.9 p -94.9 -43.82 8.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.696 0.399 . . . . 0.0 111.23 -174.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.687 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 19.6 m -132.93 162.34 58.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.478 0.711 . . . . 0.0 110.183 -175.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.6 115.86 2.75 Favored 'Trans proline' 0 C--N 1.379 2.175 0 C-N-CA 122.972 2.448 . . . . 0.0 112.247 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 70.54 9.89 7.02 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.42 1.488 . . . . 0.0 112.386 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.687 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 28.0 m -124.58 121.77 35.7 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.258 0.623 . . . . 0.0 109.418 -174.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -107.67 165.83 11.14 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.272 1.029 . . . . 0.0 109.591 -172.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 52.2 t -146.15 158.58 43.88 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 43.5 tp -69.46 138.35 53.38 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.477 0.486 . . . . 0.0 110.186 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.969 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 176.116 . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 . . . . . 0 N--CA 1.478 0.966 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 003 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.05 -29.13 72.39 Favored Glycine 0 C--N 1.343 0.929 0 O-C-N 123.996 0.81 . . . . 0.0 112.592 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -84.01 -31.89 25.21 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.445 HD11 HG21 ' A' ' 54' ' ' VAL . 2.4 tm? -65.16 -42.29 93.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.322 1.049 . . . . 0.0 109.059 172.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -62.88 -43.57 98.44 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.1 1.36 . . . . 0.0 109.444 173.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.1 tm0? -60.81 -44.12 97.29 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.006 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -68.47 -43.29 77.28 Favored 'General case' 0 C--N 1.347 0.483 0 O-C-N 123.685 0.616 . . . . 0.0 111.141 -177.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.423 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 84.7 mt -57.07 -50.33 76.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.88 -32.5 74.04 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.503 0.721 . . . . 0.0 111.29 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.45 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 20.2 tp60 -68.93 -45.27 71.22 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 123.003 0.521 . . . . 0.0 110.1 -179.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 80.5 t -62.06 -36.79 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.386 0.674 . . . . 0.0 110.303 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 96.2 mt -66.14 -39.91 90.2 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.552 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 62.6 m -72.03 -48.6 43.36 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.328 1.051 . . . . 0.0 111.984 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.8 mm-40 -68.65 -34.85 76.43 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 118.085 0.402 . . . . 0.0 111.141 -175.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.07 -39.36 90.02 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.351 170.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.12 23.03 59.09 Favored Glycine 0 C--N 1.356 1.659 0 O-C-N 123.86 0.725 . . . . 0.0 112.321 -174.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -153.43 150.15 22.91 Favored Pre-proline 0 C--O 1.24 0.569 0 C-N-CA 124.574 1.15 . . . . 0.0 108.346 -169.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.619 ' HB3' ' SG ' ' A' ' 73' ' ' CYS . 6.1 Cg_endo -48.53 112.77 0.67 Allowed 'Trans proline' 0 C--N 1.375 1.969 0 C-N-CA 123.804 3.002 . . . . 0.0 113.026 175.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 85.4 t -96.82 136.72 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -77.53 155.93 31.29 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.453 ' O ' HG21 ' A' ' 41' ' ' VAL . 23.0 tp -64.27 -46.23 84.58 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.045 0.938 . . . . 0.0 109.122 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.31 -44.37 33.87 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 0.0 112.48 168.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.69 -32.34 65.71 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 117.953 0.342 . . . . 0.0 110.363 179.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.6 mt -62.15 -35.63 79.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.849 0.459 . . . . 0.0 110.198 176.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.453 HG21 ' O ' ' A' ' 37' ' ' LEU . 61.2 t -56.06 -54.7 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.353 0.661 . . . . 0.0 111.563 177.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -71.98 -45.81 59.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.527 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.44 -39.62 94.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 68.5 m -82.24 -18.54 42.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 119.242 -0.408 . . . . 0.0 111.426 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 59.11 31.55 21.39 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.831 0.852 . . . . 0.0 109.905 -173.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.28 146.79 45.5 Favored Pre-proline 0 C--O 1.241 0.642 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.239 -169.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -63.76 129.41 24.74 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 122.802 2.335 . . . . 0.0 112.391 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.462 ' HZ2' ' HB3' ' A' ' 48' ' ' LYS . 5.1 ttpm? -51.78 -28.67 16.16 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 124.341 1.026 . . . . 0.0 112.925 177.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.3 mtm180 -53.96 -57.03 12.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.525 0.73 . . . . 0.0 110.392 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -66.75 -44.45 81.47 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.768 -175.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.429 HD23 HD12 ' A' ' 20' ' ' LEU . 92.2 mt -55.71 -56.38 21.08 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 124.208 0.942 . . . . 0.0 110.401 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -48.7 -53.11 20.11 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.798 1.239 . . . . 0.0 111.374 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -52.15 -56.89 11.67 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 124.1 0.96 . . . . 0.0 112.619 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.648 HG12 ' SD ' ' A' ' 58' ' ' MET . 60.7 t -66.68 -35.56 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.001 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.401 HD12 ' NE1' ' A' ' 72' ' ' TRP . 36.3 mt -52.15 -48.79 64.72 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.479 1.111 . . . . 0.0 113.262 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -73.88 -25.18 59.9 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 118.253 0.479 . . . . 0.0 110.782 -175.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -67.59 -52.28 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.587 0.755 . . . . 0.0 109.418 172.309 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.648 ' SD ' HG12 ' A' ' 54' ' ' VAL . 70.7 mtp -59.74 -26.58 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.489 1.116 . . . . 0.0 111.368 176.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -70.99 -37.2 72.71 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.777 0.431 . . . . 0.0 110.167 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.31 -30.67 68.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.088 0.555 . . . . 0.0 110.412 173.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -77.62 -5.66 51.09 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.267 0.627 . . . . 0.0 111.271 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 55.4 mt 68.13 17.58 9.41 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.884 1.274 . . . . 0.0 111.037 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -81.75 -28.67 33.21 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.889 1.276 . . . . 0.0 111.803 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.434 HG11 ' HE1' ' A' ' 58' ' ' MET . 32.9 m -130.86 158.8 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.225 0.61 . . . . 0.0 109.665 174.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.5 m -143.65 149.45 37.28 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -101.28 108.54 20.21 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.429 HG23 ' SG ' ' A' ' 73' ' ' CYS . 33.7 p -99.04 -32.21 11.39 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.25 0.548 . . . . 0.0 111.093 -176.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.575 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 35.8 t -140.22 153.83 69.36 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -43.67 114.18 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.519 0 C-N-CA 123.549 2.833 . . . . 0.0 114.011 175.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 59.8 26.89 16.11 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.753 1.221 . . . . 0.0 112.117 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.575 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 41.9 m -130.88 125.33 33.28 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 123.259 0.624 . . . . 0.0 109.516 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . 0.401 ' NE1' HD12 ' A' ' 55' ' ' LEU . 67.0 m95 -117.44 146.53 43.41 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.023 0.929 . . . . 0.0 109.205 -170.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.619 ' SG ' ' HB3' ' A' ' 34' ' ' PRO . 78.4 m -113.68 158.66 20.59 Favored 'General case' 0 C--O 1.25 1.115 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 33.1 tp -64.97 102.31 0.6 Allowed 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.988 174.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.497 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.945 178.331 . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 111.618 0.229 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 004 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.18 -39.34 94.38 Favored Glycine 0 C--N 1.344 1.024 0 O-C-N 123.351 0.407 . . . . 0.0 113.683 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -77.77 -30.95 51.7 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.702 0.401 . . . . 0.0 110.209 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.558 HD21 ' SG ' ' A' ' 44' ' ' CYS . 3.0 tm? -60.92 -46.99 88.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.839 1.256 . . . . 0.0 109.529 173.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.677 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 21.0 tt0 -58.19 -51.6 69.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.799 1.24 . . . . 0.0 110.352 177.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -63.95 -34.66 78.48 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.68 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -68.66 -46.15 69.88 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.078 0.551 . . . . 0.0 112.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.5 mt -59.33 -50.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 122.753 0.421 . . . . 0.0 110.111 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.9 mt -64.87 -31.89 73.33 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.317 0.647 . . . . 0.0 110.636 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.47 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 22.1 tt0 -68.68 -47.95 65.17 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.103 0.561 . . . . 0.0 110.14 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.58 -36.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.246 1.018 . . . . 0.0 110.848 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.57 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 89.1 mt -67.48 -40.29 85.28 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.644 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 53.1 m -66.12 -48.04 72.15 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.015 0.926 . . . . 0.0 111.428 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 21.9 mm-40 -67.91 -38.94 83.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.457 0.703 . . . . 0.0 111.575 -174.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.52 96.14 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.877 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.96 28.57 72.21 Favored Glycine 0 C--N 1.351 1.389 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.057 -172.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.2 m -153.8 158.55 32.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 124.428 1.091 . . . . 0.0 109.029 -169.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -60.49 122.03 10.66 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.219 1.946 . . . . 0.0 112.106 169.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.3 t -107.74 130.68 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.432 1.093 . . . . 0.0 108.756 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.6 mttt -66.81 152.53 45.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 122.966 0.506 . . . . 0.0 110.837 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.485 ' O ' HG23 ' A' ' 41' ' ' VAL . 27.6 tp -59.72 -45.27 92.67 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 123.949 0.781 . . . . 0.0 109.817 174.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.33 -42.69 2.28 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.909 1.283 . . . . 0.0 113.818 168.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -84.68 -29.79 25.34 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.64 -33.03 74.2 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.728 0.411 . . . . 0.0 110.201 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.507 ' HA ' HD12 ' A' ' 51' ' ' LEU . 42.8 t -59.46 -55.15 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.56 0.744 . . . . 0.0 111.716 175.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -71.93 -39.58 69.35 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.456 -174.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -67.32 -50.53 59.71 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.947 0.499 . . . . 0.0 111.92 177.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.558 ' SG ' HD21 ' A' ' 20' ' ' LEU . 10.0 t -79.11 -12.85 60.01 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.842 0.457 . . . . 0.0 110.911 -175.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 61.78 28.97 17.84 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.818 1.247 . . . . 0.0 111.868 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -122.14 155.59 61.16 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 123.953 0.901 . . . . 0.0 111.367 -172.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.64 129.44 23.63 Favored 'Trans proline' 0 C--N 1.381 2.28 0 C-N-CA 122.169 1.912 . . . . 0.0 111.548 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HA ' HD11 ' A' ' 51' ' ' LEU . 40.9 ttmt -45.26 -41.01 8.09 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 124.722 1.209 . . . . 0.0 113.027 175.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -54.14 -46.92 72.35 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.269 1.027 . . . . 0.0 112.031 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -66.5 -43.49 85.16 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.652 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.523 HD11 ' HA ' ' A' ' 48' ' ' LYS . 85.2 mt -56.83 -52.02 66.71 Favored 'General case' 0 C--N 1.358 0.974 0 O-C-N 124.227 0.954 . . . . 0.0 111.252 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -48.47 -55.89 9.73 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.625 1.17 . . . . 0.0 111.966 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -60.56 -41.6 94.89 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.79 -174.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.4 t -69.56 -44.11 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 122.497 0.319 . . . . 0.0 110.299 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.407 HD13 ' NE1' ' A' ' 72' ' ' TRP . 35.4 mt -50.68 -49.49 57.21 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.917 1.287 . . . . 0.0 113.254 178.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.423 ' O ' ' HG2' ' A' ' 60' ' ' LYS . 69.1 m-85 -70.4 -27.55 64.38 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 119.038 0.835 . . . . 0.0 111.33 -177.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -72.26 -44.74 62.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.333 0.653 . . . . 0.0 109.496 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.677 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 71.5 mtm -64.49 -31.12 72.19 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.54 0.736 . . . . 0.0 111.217 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -66.61 -35.19 79.6 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.17 0.988 . . . . 0.0 110.974 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 56' ' ' TYR . 74.3 mmtt -57.51 -36.8 72.02 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.493 0.717 . . . . 0.0 111.14 170.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -90.55 5.1 49.2 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.321 1.048 . . . . 0.0 111.174 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 61.26 20.37 10.97 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.484 1.514 . . . . 0.0 112.798 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.555 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 95.2 mttt -70.68 -38.96 73.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.703 0.801 . . . . 0.0 110.637 176.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.5 m -125.04 154.21 32.89 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 C-N-CA 123.778 0.831 . . . . 0.0 109.356 175.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -138.88 143.88 38.94 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.405 1.082 . . . . 0.0 108.594 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.22 105.14 17.25 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -173.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.8 p -87.25 -36.92 17.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.706 0.802 . . . . 0.0 111.578 -173.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.558 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 27.7 m -137.14 163.79 46.68 Favored Pre-proline 0 CA--C 1.551 0.986 0 CA-C-O 117.526 -1.226 . . . . 0.0 107.709 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.403 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 25.6 Cg_exo -20.37 -63.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.399 3.205 1 C-N-CA 125.967 4.445 . . . . 0.0 116.785 -176.265 . . . . . . . . 3 3 . 1 . 004 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.77 10.39 8.97 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.228 0.611 . . . . 0.0 112.061 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.598 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 26.5 m -85.41 126.95 34.19 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.87 0.366 . . . . 0.0 110.562 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . 0.407 ' NE1' HD13 ' A' ' 55' ' ' LEU . 90.7 m95 -108.15 166.17 10.94 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.549 1.14 . . . . 0.0 109.402 -177.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 47.4 t -150.17 157.22 42.87 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.57 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 29.3 tp -79.31 112.76 16.86 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.871 0 O-C-N 123.816 0.698 . . . . 0.0 112.336 176.3 . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 . . . . . . . . . 0 0 . 1 . 005 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.35 -27.88 73.35 Favored Glycine 0 N--CA 1.472 1.056 0 O-C-N 123.419 0.449 . . . . 0.0 114.008 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -75.74 -38.0 58.85 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.617 0.767 . . . . 0.0 110.288 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.475 HD13 HG21 ' A' ' 54' ' ' VAL . 2.6 tm? -64.3 -41.63 96.77 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.058 0.943 . . . . 0.0 109.976 175.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.432 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 43.0 tt0 -63.52 -40.61 97.49 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.123 0.969 . . . . 0.0 110.422 173.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.52 -36.97 84.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.9 177.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.41 ' O ' HG23 ' A' ' 27' ' ' VAL . 1.3 mmp_? -62.07 -50.4 72.11 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.193 0.597 . . . . 0.0 110.961 172.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.2 mt -56.64 -47.97 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.024 0.828 . . . . 0.0 110.442 -176.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.576 HD21 ' HB3' ' A' ' 63' ' ' LYS . 78.1 mt -60.54 -46.81 88.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.515 0.726 . . . . 0.0 111.57 178.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -66.21 -43.18 87.45 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 123.668 0.605 . . . . 0.0 111.116 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 23' ' ' ARG . 70.9 t -61.02 -46.27 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.443 0.697 . . . . 0.0 110.163 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.454 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.8 mt -66.81 -29.74 69.75 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.677 -179.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.512 ' HA ' HD22 ' A' ' 74' ' ' LEU . 89.3 m -72.33 -49.77 31.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.717 0.807 . . . . 0.0 111.725 176.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.81 -32.25 72.68 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.107 0.563 . . . . 0.0 110.992 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.75 -41.17 88.22 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.312 0.645 . . . . 0.0 110.89 169.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.45 23.35 64.6 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.941 -172.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -158.57 158.73 29.69 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 125.221 1.408 . . . . 0.0 109.091 -167.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.553 ' HA ' ' HA ' ' A' ' 73' ' ' CYS . 19.4 Cg_endo -60.34 128.32 25.81 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.512 2.141 . . . . 0.0 112.253 172.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.8 t -106.54 140.07 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 124.425 1.09 . . . . 0.0 108.201 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -74.46 157.97 34.65 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 123.5 0.72 . . . . 0.0 110.854 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 34.3 tp -68.13 -44.9 75.05 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.355 1.062 . . . . 0.0 111.068 -174.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.12 -34.83 10.42 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 168.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.448 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 49.6 tt0 -85.91 -29.45 23.62 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.93 -25.95 68.37 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.677 0.391 . . . . 0.0 110.331 176.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.622 ' HA ' HD13 ' A' ' 51' ' ' LEU . 60.0 t -64.22 -51.43 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 122.991 0.516 . . . . 0.0 110.474 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -74.95 -47.16 30.9 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.603 0.565 . . . . 0.0 111.612 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.448 ' HG2' ' HG2' ' A' ' 39' ' ' GLN . 46.5 mm-40 -61.54 -49.41 76.82 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 59.1 m -82.1 -8.96 59.68 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 56.92 46.55 19.39 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.698 1.199 . . . . 0.0 111.955 176.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.36 146.8 26.28 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.778 178.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -54.72 150.04 38.01 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.116 2.544 . . . . 0.0 112.998 172.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.481 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.1 ttmt -50.29 -34.67 24.32 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.86 1.264 . . . . 0.0 111.99 175.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -53.29 -48.93 67.95 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.166 0.987 . . . . 0.0 112.009 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -66.25 -47.05 75.01 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.46 177.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.622 HD13 ' HA ' ' A' ' 41' ' ' VAL . 41.9 mt -59.84 -58.83 6.85 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.572 -173.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -52.66 -52.86 53.9 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 124.632 1.207 . . . . 0.0 112.074 -174.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.18 -37.07 76.48 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.028 0.83 . . . . 0.0 111.614 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.475 HG21 HD13 ' A' ' 20' ' ' LEU . 87.9 t -73.09 -41.98 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 173.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.7 -37.21 78.21 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.405 1.082 . . . . 0.0 113.693 -175.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -73.21 -27.64 61.73 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 118.652 0.66 . . . . 0.0 110.691 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 54' ' ' VAL . 4.1 ptt180 -70.79 -44.97 65.53 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.481 ' HE1' HG11 ' A' ' 64' ' ' VAL . 92.6 mtp -66.88 -37.88 85.25 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 124.419 1.088 . . . . 0.0 111.116 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.4 -38.62 90.51 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.678 0.391 . . . . 0.0 110.338 178.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.97 -27.63 67.61 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.663 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -91.33 8.73 34.67 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.983 0.913 . . . . 0.0 112.39 176.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 63.44 17.16 10.12 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 123.806 0.842 . . . . 0.0 112.263 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.576 ' HB3' HD21 ' A' ' 25' ' ' LEU . 98.3 mttt -82.27 -34.91 28.54 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 124.124 0.97 . . . . 0.0 111.4 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.481 HG11 ' HE1' ' A' ' 58' ' ' MET . 18.8 m -132.85 162.53 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.227 0.611 . . . . 0.0 109.997 176.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.6 m -131.06 142.95 50.34 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.411 0.684 . . . . 0.0 109.543 175.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 41.8 tp -92.51 101.08 13.52 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 175.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 31.9 p -85.13 -37.25 20.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.835 0.854 . . . . 0.0 111.667 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.534 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 15.9 t -140.32 155.1 70.3 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_exo -26.84 -59.51 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.52 1 C-N-CA 125.356 4.037 . . . . 0.0 116.865 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -120.05 42.06 3.03 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 111.178 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.534 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 34.1 m -131.95 126.7 34.69 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 123.239 0.616 . . . . 0.0 109.657 174.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -120.87 140.77 51.33 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.228 1.011 . . . . 0.0 109.064 -172.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 50.8 t -117.9 162.74 17.63 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 123.833 0.853 . . . . 0.0 110.168 -175.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.512 HD22 ' HA ' ' A' ' 29' ' ' THR . 41.3 tp -69.78 105.69 2.85 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 172.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.502 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 171.723 . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 . . . . . . . . . 0 0 . 1 . 006 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.09 -36.84 94.01 Favored Glycine 0 C--N 1.348 1.224 0 N-CA-C 113.747 0.259 . . . . 0.0 113.747 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -71.58 -39.26 70.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.68 0.392 . . . . 0.0 110.287 177.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 51' ' ' LEU . 2.0 tm? -63.24 -46.5 86.64 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.758 1.223 . . . . 0.0 109.566 177.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.462 ' HG3' ' HE2' ' A' ' 58' ' ' MET . 35.9 tt0 -63.51 -47.18 82.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.624 1.169 . . . . 0.0 110.306 -178.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -63.21 -39.04 93.5 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.454 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.429 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -64.59 -43.27 94.35 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.0 0.52 . . . . 0.0 110.237 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 20' ' ' LEU . 87.5 mt -58.43 -52.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 123.977 0.798 . . . . 0.0 110.076 177.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.528 HD21 ' HB3' ' A' ' 63' ' ' LYS . 96.0 mt -56.8 -38.45 72.58 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.599 0.76 . . . . 0.0 111.01 -178.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -65.17 -48.91 71.83 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.316 1.01 . . . . 0.0 110.99 -178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 23' ' ' ARG . 93.5 t -57.55 -41.71 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.596 0.758 . . . . 0.0 110.825 177.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.586 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 85.4 mt -63.95 -38.92 92.84 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.953 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.2 m -69.69 -46.12 66.76 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 123.616 0.766 . . . . 0.0 111.495 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.19 -38.31 90.65 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.527 0.731 . . . . 0.0 110.942 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.38 -44.19 83.78 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.509 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 20.19 66.89 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.194 -173.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 54.9 p -159.92 153.79 19.48 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.915 1.286 . . . . 0.0 109.155 -168.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.48 123.53 9.38 Favored 'Trans proline' 0 C--N 1.378 2.114 0 C-N-CA 123.65 2.9 . . . . 0.0 114.155 -178.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.3 t -108.51 129.73 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 124.626 1.171 . . . . 0.0 108.611 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 61.0 mttp -70.52 153.55 42.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.994 0.518 . . . . 0.0 110.66 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.46 ' O ' HG23 ' A' ' 41' ' ' VAL . 53.5 tp -59.76 -48.11 83.0 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 123.885 0.74 . . . . 0.0 109.993 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.31 -41.64 19.56 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.576 1.15 . . . . 0.0 113.071 170.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.416 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 53.4 tt0 -73.29 -37.68 66.14 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 122.933 0.493 . . . . 0.0 110.734 178.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.41 -34.97 73.11 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.361 0.664 . . . . 0.0 110.466 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' ' 37' ' ' LEU . 35.9 t -56.88 -56.64 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.642 0.777 . . . . 0.0 111.711 176.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -69.29 -37.96 78.08 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 123.726 0.641 . . . . 0.0 111.735 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 29.7 mm-40 -63.75 -55.82 20.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.098 0.559 . . . . 0.0 111.911 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 41.8 t -76.95 -18.43 58.25 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 122.778 0.431 . . . . 0.0 110.792 -174.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 62.21 23.78 14.1 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.942 1.297 . . . . 0.0 110.996 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.19 153.15 49.77 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.554 1.142 . . . . 0.0 109.829 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.475 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 10.5 Cg_endo -54.37 131.16 43.72 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.032 2.488 . . . . 0.0 112.45 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -42.51 -44.89 4.28 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.168 1.387 . . . . 0.0 113.488 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.408 ' HG3' ' N ' ' A' ' 50' ' ' GLU . 47.7 ptt85 -57.66 -39.93 78.16 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 123.765 0.666 . . . . 0.0 111.829 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.475 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 6.2 tp10 -66.53 -49.38 66.69 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 123.566 0.746 . . . . 0.0 109.933 -178.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.585 ' HA ' HD11 ' A' ' 20' ' ' LEU . 22.3 mt -58.56 -57.21 13.95 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.666 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.471 ' HA ' HD12 ' A' ' 55' ' ' LEU . 22.0 t-20 -50.47 -53.74 27.43 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.697 1.599 . . . . 0.0 112.402 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -58.0 -49.39 77.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.248 0.619 . . . . 0.0 111.702 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.476 HG13 ' SD ' ' A' ' 58' ' ' MET . 70.3 t -63.91 -37.57 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.383 0.673 . . . . 0.0 110.675 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.471 HD12 ' HA ' ' A' ' 52' ' ' ASN . 32.1 mt -54.08 -35.2 61.82 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.441 1.096 . . . . 0.0 112.751 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.401 ' O ' ' HG3' ' A' ' 60' ' ' LYS . 59.1 m-85 -69.93 -34.55 73.61 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.466 0.576 . . . . 0.0 111.782 178.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -66.7 -49.25 66.68 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' HG13 ' A' ' 54' ' ' VAL . 72.4 mtp -62.0 -36.01 80.23 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.263 1.025 . . . . 0.0 111.335 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -64.44 -39.58 94.09 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.943 0.897 . . . . 0.0 111.78 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 56' ' ' TYR . 88.5 mttt -67.72 -25.94 65.91 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.316 0.646 . . . . 0.0 111.453 175.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -89.53 4.74 48.3 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.56 0.744 . . . . 0.0 110.616 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 62.18 13.61 5.98 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.136 1.375 . . . . 0.0 112.642 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.528 ' HB3' HD21 ' A' ' 25' ' ' LEU . 94.5 mttt -66.5 -39.45 88.71 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.352 1.061 . . . . 0.0 110.431 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.468 HG11 ' HE3' ' A' ' 58' ' ' MET . 30.1 m -125.47 160.78 31.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-N 114.856 -1.065 . . . . 0.0 108.9 175.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.547 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 70.8 m -137.68 143.82 41.5 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.995 0.918 . . . . 0.0 108.705 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.6 101.0 12.54 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 t -92.94 -33.68 14.08 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.014 -171.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.673 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 18.5 m -139.07 162.71 50.76 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.079 0.952 . . . . 0.0 108.717 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.67 111.74 0.77 Allowed 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 122.941 2.428 . . . . 0.0 113.281 178.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 63.79 26.37 14.37 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.79 1.236 . . . . 0.0 111.538 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.673 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 87.5 m -130.2 125.6 35.33 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.769 0.828 . . . . 0.0 108.927 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -113.46 171.28 7.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.133 0.973 . . . . 0.0 109.449 -172.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 20.0 p -152.6 160.12 43.21 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.606 0.763 . . . . 0.0 109.008 177.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.586 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 26.1 tp -78.05 101.86 7.15 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.806 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.19 . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.772 -0.633 . . . . 0.0 111.738 . . . . . . . . . 0 0 . 1 . 007 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.69 -48.98 73.35 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-O 119.858 -0.412 . . . . 0.0 114.091 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -66.52 -47.34 73.23 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.989 0.515 . . . . 0.0 111.583 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.574 HD13 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -63.36 -40.54 97.55 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.72 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.1 tt0 -61.83 -48.36 80.9 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.572 1.149 . . . . 0.0 110.354 177.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -57.76 -41.08 81.2 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.484 0.713 . . . . 0.0 109.928 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.425 ' O ' HG23 ' A' ' 27' ' ' VAL . 20.2 mmm180 -68.28 -44.63 75.12 Favored 'General case' 0 C--N 1.352 0.695 0 C-N-CA 123.541 0.737 . . . . 0.0 112.398 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.474 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 53.9 mt -59.83 -50.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 21' ' ' GLU . 79.4 mt -63.92 -33.45 75.73 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.756 0.66 . . . . 0.0 110.744 -176.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -69.09 -43.72 73.93 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.469 0.708 . . . . 0.0 110.594 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 23' ' ' ARG . 72.8 t -62.66 -34.94 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.537 178.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 78.3 mt -66.62 -37.34 84.65 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.211 175.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -67.37 -52.72 36.65 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 124.193 0.997 . . . . 0.0 111.599 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -69.79 -31.46 69.4 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.102 0.561 . . . . 0.0 111.7 -171.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.94 -38.34 90.64 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.751 167.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.07 25.3 70.84 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.521 -175.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.6 p -161.17 159.75 24.33 Favored Pre-proline 0 C--O 1.245 0.859 0 C-N-CA 125.25 1.42 . . . . 0.0 109.105 -172.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.98 126.16 21.31 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.109 1.873 . . . . 0.0 112.773 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 89.3 t -104.03 138.38 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.126 0.97 . . . . 0.0 108.663 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -73.9 152.15 40.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.409 ' O ' HG23 ' A' ' 41' ' ' VAL . 26.2 tp -61.86 -46.51 89.11 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.859 0.863 . . . . 0.0 109.846 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.45 -45.05 3.06 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.902 1.281 . . . . 0.0 112.816 167.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -79.79 -30.55 40.66 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.911 0.484 . . . . 0.0 111.034 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.97 -30.82 71.87 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.161 0.584 . . . . 0.0 110.997 178.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.498 ' HA ' HD11 ' A' ' 51' ' ' LEU . 64.4 t -55.75 -56.35 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.692 0.797 . . . . 0.0 112.024 176.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -68.85 -42.44 77.12 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 123.567 0.542 . . . . 0.0 111.668 -175.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -66.92 -49.39 65.68 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.516 0.727 . . . . 0.0 112.089 -177.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 56.9 m -81.35 -9.94 59.64 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 122.376 0.271 . . . . 0.0 110.805 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 60.13 29.49 19.05 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.481 1.112 . . . . 0.0 111.401 175.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.7 156.06 65.45 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 123.525 0.73 . . . . 0.0 111.003 -173.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.62 133.0 32.67 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.644 2.229 . . . . 0.0 111.938 174.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.402 ' HA ' HD13 ' A' ' 51' ' ' LEU . 40.0 ttmt -46.97 -36.69 8.01 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.959 1.303 . . . . 0.0 113.072 174.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.0 mtm180 -54.6 -49.09 71.27 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.665 0.786 . . . . 0.0 110.957 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -67.15 -46.96 72.49 Favored 'General case' 0 C--O 1.25 1.126 0 C-N-CA 123.891 0.876 . . . . 0.0 110.659 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.498 HD11 ' HA ' ' A' ' 41' ' ' VAL . 95.9 mt -53.68 -51.74 62.25 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.997 0.919 . . . . 0.0 111.496 -176.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -53.47 -50.99 64.15 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 124.621 1.201 . . . . 0.0 112.444 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -57.07 -39.88 75.81 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.993 0.808 . . . . 0.0 111.269 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.574 HG21 HD13 ' A' ' 20' ' ' LEU . 98.2 t -71.49 -43.79 71.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.567 0.747 . . . . 0.0 110.993 176.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.454 HD11 ' NE1' ' A' ' 72' ' ' TRP . 79.6 mt -54.04 -45.05 71.53 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.474 1.109 . . . . 0.0 113.368 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.78 -25.4 59.04 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.112 0.414 . . . . 0.0 111.534 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -68.37 -53.52 23.4 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.72 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 68.7 mtm -60.79 -31.86 71.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.995 0.918 . . . . 0.0 110.987 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -62.62 -46.81 86.55 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.828 0.851 . . . . 0.0 110.861 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.603 ' HB2' ' HZ3' ' A' ' 60' ' ' LYS . 4.9 ttmp? -68.18 -26.11 65.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.443 0.697 . . . . 0.0 111.418 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -90.4 -0.0 57.46 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.314 0.646 . . . . 0.0 111.516 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 67.75 10.99 8.16 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 124.928 1.291 . . . . 0.0 112.845 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.1 mttt -69.51 -28.24 65.88 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.656 0.783 . . . . 0.0 111.04 174.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.0 161.23 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.544 0.738 . . . . 0.0 110.048 171.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.7 m -139.08 152.21 47.34 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.75 0.82 . . . . 0.0 108.876 172.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.7 tp -101.25 106.96 18.22 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.2 p -92.97 -39.79 10.92 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.636 0.775 . . . . 0.0 111.178 -175.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.524 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 25.3 m -140.68 167.04 18.97 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 123.854 0.861 . . . . 0.0 109.249 -173.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.71 112.43 0.69 Allowed 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 123.124 2.549 . . . . 0.0 113.429 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 62.63 18.96 10.98 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.372 1.069 . . . . 0.0 112.856 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.524 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 31.4 m -119.78 123.17 43.07 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 123.574 0.75 . . . . 0.0 110.0 -174.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . 0.454 ' NE1' HD11 ' A' ' 55' ' ' LEU . 62.5 m95 -119.32 151.63 38.12 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.339 1.055 . . . . 0.0 109.614 -169.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 24.4 p -128.22 157.03 41.98 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 109.337 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 46.3 tp -77.61 131.19 37.68 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.937 0.495 . . . . 0.0 110.839 -178.558 . . . . . . . . 1 1 . 1 . 007 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 1.281 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 171.69 . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 . . . . . . . . . 0 0 . 1 . 008 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.32 -38.86 96.94 Favored Glycine 0 C--N 1.342 0.878 0 O-C-N 123.392 0.433 . . . . 0.0 113.012 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.5 m-70 -73.43 -36.21 65.9 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.191 0.52 . . . . 0.0 110.52 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.521 HD13 HG21 ' A' ' 54' ' ' VAL . 2.0 tm? -65.82 -42.53 90.49 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.304 1.042 . . . . 0.0 110.148 174.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.454 ' HG3' ' HE1' ' A' ' 58' ' ' MET . 40.2 tt0 -61.35 -42.8 99.28 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.787 0.835 . . . . 0.0 109.898 177.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -42.54 93.92 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.948 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.415 ' O ' HG22 ' A' ' 27' ' ' VAL . 12.7 tpt180 -67.16 -42.27 84.59 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.137 -177.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 78.5 mt -57.01 -49.61 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 O-C-N 123.909 0.756 . . . . 0.0 109.876 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.572 HD23 ' HB3' ' A' ' 63' ' ' LYS . 92.0 mt -59.24 -39.59 83.25 Favored 'General case' 0 C--N 1.349 0.547 0 O-C-N 123.987 0.804 . . . . 0.0 111.142 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -66.62 -45.44 79.1 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.667 0.605 . . . . 0.0 110.911 -176.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 23' ' ' ARG . 86.6 t -56.34 -42.83 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.289 0.636 . . . . 0.0 110.279 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 97.8 mt -71.9 -34.59 69.25 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.635 -177.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.434 ' HA ' HD23 ' A' ' 74' ' ' LEU . 27.3 m -70.63 -45.65 64.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.314 0.646 . . . . 0.0 111.68 179.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.1 -33.17 74.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.913 0.485 . . . . 0.0 110.867 -177.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.68 -44.88 66.11 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.705 0.628 . . . . 0.0 110.345 172.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.42 25.52 67.0 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.782 -170.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.7 m -148.41 155.29 42.46 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 124.082 0.953 . . . . 0.0 110.314 -166.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -60.53 109.21 0.61 Allowed 'Trans proline' 0 C--N 1.368 1.564 0 C-N-CA 123.063 2.509 . . . . 0.0 112.089 169.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.5 t -97.12 130.65 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.991 0.916 . . . . 0.0 108.531 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.64 153.29 43.64 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.472 ' O ' HG21 ' A' ' 41' ' ' VAL . 36.1 tp -59.18 -45.46 90.99 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.991 0.807 . . . . 0.0 110.23 -178.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.58 -47.27 10.29 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.362 1.065 . . . . 0.0 112.94 170.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.431 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.9 tt0 -77.32 -34.89 55.27 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.002 0.521 . . . . 0.0 110.397 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.8 mt -56.76 -41.51 77.72 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.618 0.767 . . . . 0.0 110.591 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.474 ' HA ' HD13 ' A' ' 51' ' ' LEU . 92.1 t -53.59 -56.34 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 124.243 0.965 . . . . 0.0 111.635 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -74.59 -35.18 62.99 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.27 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 13.7 mm-40 -69.98 -45.86 66.44 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 122.713 0.405 . . . . 0.0 112.088 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.548 ' SG ' HD23 ' A' ' 51' ' ' LEU . 23.8 p -72.6 -19.66 61.43 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.399 0.279 . . . . 0.0 111.042 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 64.8 37.84 7.1 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 124.292 1.037 . . . . 0.0 110.106 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.534 ' HB2' ' SG ' ' A' ' 44' ' ' CYS . . . -134.64 159.45 72.16 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.679 -173.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.71 134.81 22.68 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.426 2.084 . . . . 0.0 111.95 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.402 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.3 ttmt -50.21 -31.84 14.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.669 1.188 . . . . 0.0 113.086 175.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -61.03 -48.64 80.84 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 122.622 0.369 . . . . 0.0 111.183 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -65.86 -46.61 77.8 Favored 'General case' 0 C--O 1.242 0.691 0 O-C-N 123.772 0.67 . . . . 0.0 110.55 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.548 HD23 ' SG ' ' A' ' 44' ' ' CYS . 93.8 mt -55.06 -58.61 6.95 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 124.267 0.98 . . . . 0.0 110.746 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -48.13 -53.24 17.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.658 1.583 . . . . 0.0 112.216 -174.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -56.52 -48.83 76.4 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 123.945 0.778 . . . . 0.0 112.423 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.583 HG12 ' SD ' ' A' ' 58' ' ' MET . 70.1 t -63.63 -43.73 98.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 123.734 0.647 . . . . 0.0 110.726 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 77.0 mt -50.7 -43.9 57.9 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.237 1.415 . . . . 0.0 113.739 -177.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.455 ' O ' ' HG3' ' A' ' 60' ' ' LYS . 92.5 m-85 -73.1 -30.92 64.0 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.508 0.595 . . . . 0.0 112.21 -178.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.4 ttt85 -74.02 -51.99 14.13 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.443 0.297 . . . . 0.0 110.209 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.583 ' SD ' HG12 ' A' ' 54' ' ' VAL . 19.7 ptm -65.82 -19.26 65.82 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.137 0.575 . . . . 0.0 110.812 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -65.46 -44.31 87.6 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.555 0.742 . . . . 0.0 110.759 171.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 56' ' ' TYR . 61.3 mttm -66.35 -31.68 72.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.637 0.775 . . . . 0.0 110.826 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -84.45 6.24 24.19 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.227 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.81 10.93 7.24 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.872 1.269 . . . . 0.0 112.305 176.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.572 ' HB3' HD23 ' A' ' 25' ' ' LEU . 92.3 mttt -70.85 -34.97 72.19 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.586 0.754 . . . . 0.0 110.505 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.474 HG11 ' HE2' ' A' ' 58' ' ' MET . 16.4 m -133.64 160.33 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.289 0.635 . . . . 0.0 109.731 174.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.1 m -125.45 150.6 47.17 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.5 tp -104.49 104.67 14.56 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.1 p -87.73 -42.75 12.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.73 0.812 . . . . 0.0 110.896 -172.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.514 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 30.7 m -139.84 170.63 9.41 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.035 0.934 . . . . 0.0 109.486 -174.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.32 106.49 0.08 OUTLIER 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 123.418 2.746 . . . . 0.0 114.071 173.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.04 20.0 10.46 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.765 1.226 . . . . 0.0 112.626 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.514 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 34.6 m -114.64 118.47 33.76 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.61 0.764 . . . . 0.0 109.153 -174.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 58.3 m95 -116.92 139.15 50.98 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.948 0.899 . . . . 0.0 109.314 -169.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 45.8 t -117.38 165.08 13.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.029 0.532 . . . . 0.0 109.902 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 29' ' ' THR . 45.5 tp -65.93 111.64 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 122.969 0.508 . . . . 0.0 110.112 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.57 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 175.303 . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 009 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.4 99.75 Favored Glycine 0 C--N 1.351 1.378 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -69.21 -45.65 69.36 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -177.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.526 HD11 HD23 ' A' ' 51' ' ' LEU . 2.6 tm? -64.69 -37.26 86.98 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.125 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.552 ' HG3' ' HE2' ' A' ' 58' ' ' MET . 38.1 tt0 -60.91 -50.85 71.76 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.235 1.014 . . . . 0.0 110.461 175.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -62.62 -31.87 72.79 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 124.617 1.198 . . . . 0.0 110.559 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -71.35 -44.11 65.68 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.11 0.564 . . . . 0.0 111.311 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.559 ' HB ' ' HE3' ' A' ' 58' ' ' MET . 79.5 mt -60.53 -47.41 92.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 177.094 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.67 -36.05 73.54 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.678 0.791 . . . . 0.0 110.66 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -65.45 -48.71 71.78 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.034 0.834 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 71.4 t -58.56 -39.42 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.883 0.873 . . . . 0.0 110.752 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -68.46 -38.89 81.5 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.098 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 67.5 m -72.18 -45.69 59.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.526 0.73 . . . . 0.0 111.991 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.16 -38.76 91.58 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.042 0.537 . . . . 0.0 110.969 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.83 83.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.414 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 67.2 22.53 72.72 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.322 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.1 p -151.39 166.73 14.49 Favored Pre-proline 0 C--O 1.246 0.901 0 C-N-CA 123.999 0.92 . . . . 0.0 109.697 -169.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.18 118.51 5.41 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.424 2.083 . . . . 0.0 111.918 171.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 99.1 t -102.5 125.29 56.8 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 67.2 mttm -69.52 155.08 41.04 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.981 0.512 . . . . 0.0 110.523 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.42 ' O ' HG21 ' A' ' 41' ' ' VAL . 33.4 tp -61.19 -49.75 75.92 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.419 0.688 . . . . 0.0 110.726 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.83 -38.37 15.81 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.841 0.857 . . . . 0.0 112.578 171.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 62.5 tt0 -75.36 -38.88 59.81 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 122.795 0.438 . . . . 0.0 110.574 176.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.412 ' O ' ' SG ' ' A' ' 44' ' ' CYS . 56.8 mt -56.98 -40.59 76.81 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.422 0.689 . . . . 0.0 110.641 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.42 HG21 ' O ' ' A' ' 37' ' ' LEU . 51.7 t -55.22 -54.07 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 123.962 0.789 . . . . 0.0 111.639 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -69.53 -39.01 77.75 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.241 0.338 . . . . 0.0 111.375 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 46.6 mm-40 -64.35 -53.67 45.06 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.601 ' SG ' HD22 ' A' ' 51' ' ' LEU . 31.6 p -76.92 -24.45 52.44 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 122.721 0.408 . . . . 0.0 111.132 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 63.3 36.61 11.6 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.107 0.963 . . . . 0.0 110.919 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.405 ' HB2' ' SG ' ' A' ' 44' ' ' CYS . . . -118.81 150.47 48.51 Favored Pre-proline 0 C--O 1.242 0.697 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.394 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.08 135.84 45.5 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.207 1.938 . . . . 0.0 111.437 177.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -50.02 -33.28 17.58 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.683 1.193 . . . . 0.0 112.64 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -61.54 -45.06 95.77 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.581 0.752 . . . . 0.0 111.74 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -65.0 -50.16 67.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.618 0.767 . . . . 0.0 110.387 174.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.601 HD22 ' SG ' ' A' ' 44' ' ' CYS . 97.0 mt -53.95 -58.89 5.63 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 124.201 1.0 . . . . 0.0 112.01 -176.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.455 ' HA ' HD13 ' A' ' 55' ' ' LEU . 5.3 m-20 -55.7 -46.43 77.68 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.554 1.159 . . . . 0.0 111.953 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -54.08 -48.82 70.25 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 123.853 0.721 . . . . 0.0 110.691 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.554 HG12 ' HE1' ' A' ' 58' ' ' MET . 56.9 t -70.15 -36.08 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.101 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' A' ' 52' ' ' ASN . 57.7 mt -53.55 -42.92 68.01 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.437 1.095 . . . . 0.0 113.649 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -72.62 -27.17 61.99 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 118.681 0.673 . . . . 0.0 111.405 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -67.35 -58.58 4.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.662 0.785 . . . . 0.0 110.473 176.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.559 ' HE3' ' HB ' ' A' ' 24' ' ' ILE . 14.4 ptp -61.56 -28.73 69.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.724 0.81 . . . . 0.0 111.561 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -65.89 -43.71 87.46 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 0.0 110.963 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.682 ' HZ1' ' HB2' ' A' ' 60' ' ' LYS . 5.0 ttmp? -63.35 -39.24 94.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.716 0.806 . . . . 0.0 111.008 174.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -82.78 4.15 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.231 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.6 mt 63.03 15.04 8.11 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.365 1.466 . . . . 0.0 112.553 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.72 -23.15 60.81 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 124.411 1.084 . . . . 0.0 110.433 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.484 HG11 ' SD ' ' A' ' 58' ' ' MET . 13.3 m -130.52 170.09 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.115 0.566 . . . . 0.0 109.933 171.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.8 t -135.0 153.37 52.11 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.345 173.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.0 tp -101.25 101.82 12.58 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 176.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.4 p -81.52 -41.68 21.34 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.965 0.506 . . . . 0.0 110.444 -176.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.547 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 42.3 t -140.21 152.3 66.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.644 0.778 . . . . 0.0 108.915 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.16 124.37 8.9 Favored 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.135 2.557 . . . . 0.0 112.431 168.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 69.31 9.53 7.36 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.155 1.382 . . . . 0.0 112.715 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 58.3 m -129.02 120.04 25.32 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.64 0.776 . . . . 0.0 109.264 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -107.15 166.81 10.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.732 0.813 . . . . 0.0 108.867 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.3 t -152.82 165.13 36.35 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.3 tp -71.12 148.39 47.47 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.14 0 O-C-N 123.497 0.498 . . . . 0.0 112.256 -179.342 . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 . . . . . . . . . 0 0 . 1 . 010 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.41 74.26 Favored Glycine 0 C--N 1.345 1.058 0 O-C-N 123.971 0.794 . . . . 0.0 114.709 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -75.99 -38.68 57.12 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.186 0.594 . . . . 0.0 109.78 177.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.538 HD13 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -64.54 -43.64 93.34 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.712 176.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -65.55 -40.39 92.79 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.272 1.029 . . . . 0.0 110.043 176.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.0 -38.09 87.3 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.738 0.815 . . . . 0.0 110.223 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.429 ' O ' HG23 ' A' ' 27' ' ' VAL . 22.8 mmm180 -63.76 -50.83 67.5 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 122.737 0.415 . . . . 0.0 110.919 174.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 87.8 mt -56.1 -54.23 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 O-C-N 123.863 0.727 . . . . 0.0 110.354 -175.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.493 HD23 ' HB3' ' A' ' 63' ' ' LYS . 90.0 mt -65.01 -35.43 81.17 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.953 0.901 . . . . 0.0 111.486 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -66.09 -47.4 74.33 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.296 0.638 . . . . 0.0 110.328 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 23' ' ' ARG . 61.1 t -59.81 -40.9 83.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 124.516 1.126 . . . . 0.0 111.205 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.57 -38.65 87.52 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.742 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 73.5 m -68.73 -50.46 50.53 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.121 0.968 . . . . 0.0 111.776 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -67.44 -40.46 85.44 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.97 0.508 . . . . 0.0 110.994 -173.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -42.19 98.8 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.386 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.76 29.4 64.4 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 115.164 -0.926 . . . . 0.0 112.249 -174.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.2 m -150.94 153.89 33.71 Favored Pre-proline 0 C--O 1.242 0.665 0 C-N-CA 125.296 1.438 . . . . 0.0 107.897 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -60.98 114.05 2.0 Allowed 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.194 1.929 . . . . 0.0 111.382 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.7 t -96.23 128.21 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.357 1.063 . . . . 0.0 108.281 -176.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 49.0 mtmt -58.58 154.72 13.68 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.447 0.699 . . . . 0.0 111.397 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.5 tp -67.43 -50.74 58.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.017 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -53.67 -28.1 31.42 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -81.88 -30.64 31.87 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.909 0.484 . . . . 0.0 109.882 177.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.36 -26.38 67.24 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.138 0.575 . . . . 0.0 110.087 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.459 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.5 t -58.52 -53.23 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.498 0.719 . . . . 0.0 111.4 174.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -70.79 -40.72 72.38 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -69.46 -51.77 32.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.972 0.509 . . . . 0.0 112.128 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 57.2 m -78.03 -13.22 59.95 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.385 0.274 . . . . 0.0 110.789 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 60.38 31.39 20.36 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.008 1.323 . . . . 0.0 111.891 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.24 154.43 56.13 Favored Pre-proline 0 N--CA 1.473 0.681 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.501 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.427 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 11.4 Cg_endo -56.12 136.72 76.56 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.81 2.34 . . . . 0.0 111.632 169.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.407 ' HA ' HD13 ' A' ' 51' ' ' LEU . 26.0 ttpp -48.96 -41.5 34.32 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.196 0.998 . . . . 0.0 112.225 172.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.427 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 21.8 ptt180 -59.0 -37.62 77.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.826 0.45 . . . . 0.0 111.924 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.8 tp10 -66.79 -50.15 63.58 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 123.727 0.811 . . . . 0.0 110.029 175.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.459 HD11 ' HA ' ' A' ' 41' ' ' VAL . 76.7 mt -57.22 -50.08 74.0 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.157 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -52.07 -51.54 56.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.465 1.103 . . . . 0.0 111.504 -176.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -66.86 -37.06 83.73 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 124.127 0.892 . . . . 0.0 111.524 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.696 HG12 ' SD ' ' A' ' 58' ' ' MET . 95.7 t -66.38 -47.52 83.76 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.3 mt -57.72 -37.77 74.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.223 1.409 . . . . 0.0 112.888 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -68.54 -28.64 67.16 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 122.903 0.481 . . . . 0.0 111.413 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -71.54 -53.55 13.44 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 171.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.696 ' SD ' HG12 ' A' ' 54' ' ' VAL . 77.9 mtp -61.01 -32.38 71.98 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.971 1.308 . . . . 0.0 113.051 -172.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -70.44 -34.16 72.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.366 0.266 . . . . 0.0 111.162 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -71.54 -24.56 61.97 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.377 0.671 . . . . 0.0 110.326 173.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.07 5.8 42.79 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.368 1.067 . . . . 0.0 110.718 174.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 60.7 14.93 5.39 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.341 1.456 . . . . 0.0 112.775 177.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.493 ' HB3' HD23 ' A' ' 25' ' ' LEU . 96.3 mttt -73.97 -40.9 62.68 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.214 1.006 . . . . 0.0 110.838 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.462 HG11 ' HE1' ' A' ' 58' ' ' MET . 33.1 m -126.45 158.35 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.492 0.717 . . . . 0.0 110.517 179.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.1 m -135.63 150.27 49.58 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.627 1.171 . . . . 0.0 108.323 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.1 tp -99.96 110.77 23.09 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.5 p -82.54 -46.39 13.44 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 -177.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.447 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.4 m -133.21 163.65 49.59 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.311 -1.328 . . . . 0.0 108.18 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -25.52 -63.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.393 2.901 1 C-N-CA 125.464 4.109 . . . . 0.0 116.432 -174.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.58 53.59 1.74 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.613 0.765 . . . . 0.0 110.508 172.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 36.0 m -132.39 120.53 22.15 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 172.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -106.21 169.17 8.66 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.449 1.1 . . . . 0.0 109.273 -174.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.2 t -151.16 159.96 44.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.656 0.782 . . . . 0.0 109.633 -175.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 35.7 tp -72.89 104.3 4.0 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 174.634 . . . . . . . . 1 1 . 1 . 010 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.751 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.64 177.623 . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 011 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -54.42 -41.0 70.89 Favored Glycine 0 C--N 1.351 1.403 0 O-C-N 123.81 0.694 . . . . 0.0 114.37 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -75.76 -40.02 56.07 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.445 0.298 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 51' ' ' LEU . 1.5 tm? -60.0 -52.8 63.86 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.817 1.247 . . . . 0.0 110.098 -178.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.756 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.8 tt0 -62.19 -44.66 96.1 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.995 1.318 . . . . 0.0 110.513 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -56.91 -44.98 82.93 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.37 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.446 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 0.8 OUTLIER -66.27 -47.7 72.82 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.312 0.645 . . . . 0.0 112.33 -178.793 . . . . . . . . 3 3 . 1 . 011 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.8 mt -60.74 -50.99 78.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 123.589 0.556 . . . . 0.0 110.126 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -64.2 -38.36 90.77 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 111.806 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -71.47 -40.12 70.49 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.747 0.654 . . . . 0.0 110.456 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.4 t -61.89 -39.16 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.144 0.578 . . . . 0.0 110.032 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.42 -29.03 63.34 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.564 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 29' ' ' THR . . . . . 0.487 ' HA ' HD22 ' A' ' 74' ' ' LEU . 86.4 m -75.49 -44.15 45.42 Favored 'General case' 0 C--N 1.353 0.755 0 C-N-CA 123.584 0.754 . . . . 0.0 111.395 176.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -70.11 -37.25 75.3 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.498 0.719 . . . . 0.0 110.229 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.33 -39.82 71.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 122.959 0.504 . . . . 0.0 109.7 172.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.53 31.5 67.01 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.751 -175.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -160.45 149.47 13.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.946 0.899 . . . . 0.0 109.091 -166.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -60.77 113.4 1.69 Allowed 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.976 2.451 . . . . 0.0 112.712 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.3 t -102.61 138.61 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.662 1.185 . . . . 0.0 108.208 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.87 149.48 50.53 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.347 0.659 . . . . 0.0 110.588 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.457 ' O ' HG23 ' A' ' 41' ' ' VAL . 25.3 tp -59.37 -49.08 79.19 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.555 1.159 . . . . 0.0 110.953 178.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.75 -36.98 17.63 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.107 0.963 . . . . 0.0 113.117 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.522 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 51.2 tt0 -76.66 -34.48 58.25 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.45 -29.24 69.89 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.288 0.635 . . . . 0.0 110.497 177.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.501 ' HA ' HD11 ' A' ' 51' ' ' LEU . 93.9 t -59.8 -53.09 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.839 0.855 . . . . 0.0 111.155 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.439 ' HE2' ' HG3' ' A' ' 39' ' ' GLN . 63.5 pttt -73.41 -34.73 65.64 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 123.648 0.592 . . . . 0.0 111.487 -177.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 26.9 mm-40 -62.04 -55.86 24.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.63 0.372 . . . . 0.0 110.616 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 45.4 t -81.83 -10.82 59.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.674 0.39 . . . . 0.0 110.714 -174.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 56.32 32.62 20.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.787 1.235 . . . . 0.0 110.886 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.61 149.72 53.48 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.176 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -61.11 130.93 34.37 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.599 2.199 . . . . 0.0 111.609 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -44.53 -36.29 2.91 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.387 1.475 . . . . 0.0 112.924 172.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.264 1.025 . . . . 0.0 111.544 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.08 -39.52 75.56 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.229 0.612 . . . . 0.0 111.061 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.501 HD11 ' HA ' ' A' ' 41' ' ' VAL . 93.9 mt -56.66 -52.46 64.82 Favored 'General case' 0 C--N 1.359 1.005 0 O-C-N 123.938 0.774 . . . . 0.0 110.67 175.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.8 m-20 -50.54 -51.39 48.27 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 125.137 1.375 . . . . 0.0 111.886 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -50.89 -52.83 37.94 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.336 1.054 . . . . 0.0 112.032 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.39 -37.86 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.471 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.412 HD11 ' NE1' ' A' ' 72' ' ' TRP . 38.8 mt -57.39 -46.02 83.88 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.863 1.265 . . . . 0.0 114.115 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -71.08 -28.76 64.57 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 119.271 0.941 . . . . 0.0 110.908 -178.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.5 tpp85 -66.73 -50.21 63.51 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.756 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 76.0 mtm -66.68 -27.53 67.73 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 124.109 0.963 . . . . 0.0 112.138 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -67.11 -40.37 86.87 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.583 0.753 . . . . 0.0 109.891 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -71.44 -34.54 70.37 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.873 0.733 . . . . 0.0 110.747 173.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 57' ' ' ARG . 51.0 mt-10 -76.69 -5.17 46.87 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.154 0.582 . . . . 0.0 111.197 174.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.8 mt 66.04 14.03 9.4 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.783 1.633 . . . . 0.0 112.492 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.537 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.2 mttt -69.65 -35.31 75.06 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 124.374 1.07 . . . . 0.0 110.611 175.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.2 m -126.69 152.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 O-C-N 123.907 0.754 . . . . 0.0 109.479 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 45.1 t -119.86 147.39 44.75 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.14 0.976 . . . . 0.0 108.826 176.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.6 tp -99.38 101.67 13.02 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.1 p -87.69 -34.15 18.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.677 0.791 . . . . 0.0 111.456 -175.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.7 m -139.42 161.16 58.62 Favored Pre-proline 0 N--CA 1.482 1.142 0 CA-C-O 117.21 -1.376 . . . . 0.0 107.57 176.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -25.53 -59.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 125.261 3.974 . . . . 0.0 116.606 -176.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -128.83 53.4 1.86 Allowed 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.456 0.646 . . . . 0.0 110.586 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.47 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 70.1 m -130.97 127.88 39.29 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . 0.412 ' NE1' HD11 ' A' ' 55' ' ' LEU . 81.6 m95 -118.38 137.55 53.04 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.421 0.688 . . . . 0.0 110.468 -171.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 49.9 t -116.19 164.3 14.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.949 0.899 . . . . 0.0 109.518 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 29' ' ' THR . 40.9 tp -67.64 108.56 2.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 173.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.121 0 O-C-N 123.782 0.676 . . . . 0.0 112.533 176.713 . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 119.056 -0.497 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 012 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.15 -48.84 76.39 Favored Glycine 0 C--N 1.353 1.523 0 O-C-N 123.527 0.517 . . . . 0.0 114.275 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -64.98 -40.5 95.07 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.309 0.576 . . . . 0.0 110.028 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.407 HD12 HG21 ' A' ' 54' ' ' VAL . 2.9 tm? -62.0 -42.72 99.46 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.436 1.495 . . . . 0.0 110.215 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.499 ' HG3' ' HE1' ' A' ' 58' ' ' MET . 38.3 tt0 -64.05 -40.0 95.32 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.334 1.054 . . . . 0.0 110.398 177.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.71 -43.16 97.41 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.532 177.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.421 ' O ' HG22 ' A' ' 27' ' ' VAL . 42.8 mmm-85 -66.26 -45.4 80.69 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.564 0.746 . . . . 0.0 111.394 -177.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.505 HG22 HD22 ' A' ' 55' ' ' LEU . 75.5 mt -57.07 -45.41 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 123.952 0.782 . . . . 0.0 109.689 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.592 HD23 ' HB3' ' A' ' 63' ' ' LYS . 66.5 mt -65.0 -38.06 89.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.607 0.567 . . . . 0.0 111.169 -179.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.478 HE21 ' HG3' ' A' ' 30' ' ' GLU . 22.7 tp60 -69.42 -44.24 71.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.895 0.747 . . . . 0.0 109.983 -174.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 23' ' ' ARG . 98.5 t -58.85 -46.13 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.306 1.043 . . . . 0.0 110.793 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.39 -34.11 77.23 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.328 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -76.56 -45.28 31.22 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.815 0.446 . . . . 0.0 110.714 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.478 ' HG3' HE21 ' A' ' 26' ' ' GLN . 46.0 mt-10 -68.53 -42.12 78.91 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.923 0.489 . . . . 0.0 110.628 -175.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.18 -42.06 76.49 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.236 0.96 . . . . 0.0 111.758 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.75 28.06 71.03 Favored Glycine 0 C--N 1.35 1.346 0 O-C-N 123.61 0.568 . . . . 0.0 112.311 -176.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.7 p -161.38 154.56 17.8 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.541 1.137 . . . . 0.0 108.693 -172.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.43 ' HB3' HG23 ' A' ' 67' ' ' THR . 29.4 Cg_endo -60.86 124.35 14.78 Favored 'Trans proline' 0 C--N 1.374 1.916 0 C-N-CA 122.721 2.281 . . . . 0.0 112.426 178.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 72.8 t -105.41 128.06 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.9 mttt -68.29 150.6 48.05 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.422 ' O ' HG23 ' A' ' 41' ' ' VAL . 40.2 tp -56.94 -40.11 75.78 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.44 0.696 . . . . 0.0 110.071 174.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.09 -52.83 6.89 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.879 1.272 . . . . 0.0 112.227 167.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 10.2 tt0 -75.39 -25.32 57.53 Favored 'General case' 0 C--O 1.207 -1.167 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.573 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.25 -35.16 80.17 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.73 0.696 . . . . 0.0 110.525 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 37' ' ' LEU . 59.9 t -60.0 -43.03 91.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 C-N-CA 123.499 0.72 . . . . 0.0 110.082 172.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -66.82 -57.46 6.99 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.387 1.075 . . . . 0.0 111.017 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -65.37 -53.57 41.5 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.551 1.14 . . . . 0.0 112.415 -174.094 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.2 t -81.36 -12.8 58.89 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 122.732 0.413 . . . . 0.0 110.916 -175.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 67.19 13.39 9.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.3 1.44 . . . . 0.0 112.443 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -97.07 153.93 38.34 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 124.275 1.03 . . . . 0.0 111.086 -173.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.63 135.82 47.1 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.998 2.465 . . . . 0.0 112.285 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.509 ' HB2' ' HZ3' ' A' ' 48' ' ' LYS . 4.9 ttmp? -44.51 -46.09 9.62 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.573 1.149 . . . . 0.0 113.296 174.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -60.71 -39.97 90.52 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.208 0.603 . . . . 0.0 112.134 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -66.47 -50.81 62.08 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.294 0.371 . . . . 0.0 110.521 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 36.6 mt -57.38 -57.22 13.6 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 124.168 0.918 . . . . 0.0 110.395 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.418 ' HA ' HD12 ' A' ' 55' ' ' LEU . 27.8 t-20 -51.03 -52.16 45.87 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.24 1.416 . . . . 0.0 112.097 -177.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -57.79 -46.53 84.48 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.188 0.595 . . . . 0.0 111.852 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.407 HG21 HD12 ' A' ' 20' ' ' LEU . 90.7 t -63.72 -37.55 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 O-C-N 123.297 0.373 . . . . 0.0 110.141 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.505 HD22 HG22 ' A' ' 24' ' ' ILE . 30.3 mt -58.18 -30.67 66.59 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.488 1.115 . . . . 0.0 113.147 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . 0.491 ' HA ' ' HG2' ' A' ' 59' ' ' LYS . 18.7 m-85 -75.84 -25.42 56.23 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-N 119.348 0.976 . . . . 0.0 111.808 176.156 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.464 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.1 tmt_? -70.11 -50.91 36.01 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 171.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.499 ' HE1' ' HG3' ' A' ' 21' ' ' GLU . 85.2 mtp -61.69 -38.82 89.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.783 1.233 . . . . 0.0 112.345 -175.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . 0.491 ' HG2' ' HA ' ' A' ' 56' ' ' TYR . 17.5 ptpt -65.56 -37.18 85.96 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 120.785 0.326 . . . . 0.0 111.185 -176.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -68.44 -30.67 69.6 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.572 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 11.7 mm-40 -80.82 0.46 34.84 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.269 0.627 . . . . 0.0 111.237 176.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 68.23 17.44 9.33 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 125.053 1.341 . . . . 0.0 111.714 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.592 ' HB3' HD23 ' A' ' 25' ' ' LEU . 99.4 mttt -77.66 -37.02 50.78 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.347 0.659 . . . . 0.0 111.702 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.447 HG11 ' HE2' ' A' ' 58' ' ' MET . 35.3 m -127.72 146.94 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 CA-C-O 121.719 0.771 . . . . 0.0 111.303 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.7 m -109.29 134.05 52.28 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.968 1.307 . . . . 0.0 109.721 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -96.85 102.37 14.14 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 67' ' ' THR . . . . . 0.43 HG23 ' HB3' ' A' ' 34' ' ' PRO . 9.3 t -92.91 -32.94 14.4 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.257 -171.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.765 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.7 m -139.99 158.0 68.2 Favored Pre-proline 0 N--CA 1.478 0.96 0 CA-C-O 117.23 -1.367 . . . . 0.0 108.101 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -25.57 -70.12 0.04 OUTLIER 'Trans proline' 0 C--N 1.393 2.887 1 C-N-CA 125.589 4.193 . . . . 0.0 116.323 -175.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.41 17.19 20.37 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.792 0.837 . . . . 0.0 112.275 176.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.765 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 42.2 m -109.22 128.98 55.49 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 121.345 0.593 . . . . 0.0 110.439 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . 0.424 ' CE2' HD11 ' A' ' 55' ' ' LEU . 73.9 m95 -112.31 168.19 9.82 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.485 1.114 . . . . 0.0 109.235 -175.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 44.6 t -151.36 166.16 31.85 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.673 1.189 . . . . 0.0 108.391 178.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 42.6 tp -64.29 133.75 53.34 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 1.223 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 172.435 . . . . . . . . 0 0 . 1 . 013 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . 0.43 ' HG3' HG23 ' A' ' 54' ' ' VAL . 44.8 tt0 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 . . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.454 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -55.63 -38.16 70.66 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.242 0.339 . . . . 0.0 113.797 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.2 m170 -73.6 -36.56 65.53 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.02 0.528 . . . . 0.0 110.648 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.495 HD11 HD23 ' A' ' 51' ' ' LEU . 2.4 tm? -62.52 -45.39 93.2 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.202 1.001 . . . . 0.0 109.905 177.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' HE1' ' A' ' 58' ' ' MET . 37.2 tt0 -58.34 -44.78 88.89 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.498 1.119 . . . . 0.0 110.444 176.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 15.9 mm100 -60.02 -39.79 87.08 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 124.059 0.849 . . . . 0.0 111.953 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.4 ' O ' HG23 ' A' ' 27' ' ' VAL . 23.0 tpt180 -68.37 -41.71 80.22 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-O 119.64 -0.219 . . . . 0.0 110.691 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.5 mt -61.51 -47.69 92.22 Favored 'Isoleucine or valine' 0 C--N 1.358 0.956 0 O-C-N 123.316 0.385 . . . . 0.0 110.202 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.492 HD23 ' HB3' ' A' ' 63' ' ' LYS . 95.8 mt -52.69 -44.06 66.01 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.749 0.82 . . . . 0.0 111.923 174.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.15 -54.7 25.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.78 0.675 . . . . 0.0 110.768 -177.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 23' ' ' ARG . 90.5 t -56.25 -45.86 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.187 0.995 . . . . 0.0 111.434 -177.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.59 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.9 mt -64.79 -35.84 82.4 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 123.637 0.586 . . . . 0.0 111.536 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -66.45 -46.18 77.32 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.874 0.469 . . . . 0.0 111.043 176.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.53 -40.33 80.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.153 0.581 . . . . 0.0 111.184 -174.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.55 87.84 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.006 0.523 . . . . 0.0 110.318 172.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.12 37.55 94.13 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.084 -177.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.1 t -164.6 152.09 10.21 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.501 0.72 . . . . 0.0 109.682 -167.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -50.26 126.53 17.66 Favored 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 123.14 2.56 . . . . 0.0 113.177 168.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 69.0 t -118.22 128.87 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.364 1.066 . . . . 0.0 108.31 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 56.4 mtmt -65.11 150.63 47.81 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 123.366 0.416 . . . . 0.0 110.401 176.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 41' ' ' VAL . 22.6 tp -61.94 -46.94 87.14 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.648 0.593 . . . . 0.0 110.761 176.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.68 -31.54 26.22 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.3 tt0 -80.24 -37.0 33.9 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.668 0.387 . . . . 0.0 110.292 174.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.03 -31.85 69.2 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.619 0.767 . . . . 0.0 110.774 178.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.493 ' HA ' HD13 ' A' ' 51' ' ' LEU . 25.0 t -54.72 -54.2 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 123.512 0.507 . . . . 0.0 111.493 176.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -74.6 -44.66 49.65 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.452 0.47 . . . . 0.0 111.965 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 34.0 mm-40 -59.26 -54.87 41.93 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.3 t -75.21 -16.53 60.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.233 0.613 . . . . 0.0 111.105 -178.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 65.21 23.17 12.24 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.2 1.4 . . . . 0.0 112.253 177.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.17 151.01 45.3 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.115 0.966 . . . . 0.0 109.831 -178.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.606 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 19.9 Cg_endo -59.75 136.59 71.43 Favored 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 122.681 2.254 . . . . 0.0 111.921 174.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -47.95 -33.24 7.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.991 1.316 . . . . 0.0 113.285 176.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.606 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 14.2 ptp180 -59.78 -46.31 89.57 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.177 0.591 . . . . 0.0 111.037 177.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.477 ' HG3' ' HG ' ' A' ' 20' ' ' LEU . 10.3 tp10 -67.09 -49.96 63.22 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.98 0.912 . . . . 0.0 110.521 -178.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.495 HD23 HD11 ' A' ' 20' ' ' LEU . 48.2 mt -56.45 -54.07 50.01 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.93 -179.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -51.29 -49.51 61.12 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.084 1.353 . . . . 0.0 112.171 -176.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.352 0.709 0 O-C-N 123.88 0.738 . . . . 0.0 111.821 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.43 HG23 ' HG3' ' A' ' 17' ' ' GLU . 78.1 t -68.82 -36.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 122.545 0.338 . . . . 0.0 110.785 -176.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.4 mt -52.68 -37.88 59.56 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.319 1.048 . . . . 0.0 112.917 173.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -70.16 -31.48 68.99 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.642 0.655 . . . . 0.0 111.513 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -64.1 -52.43 59.25 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.427 ' HE2' HG11 ' A' ' 64' ' ' VAL . 74.9 mtp -62.02 -33.44 74.37 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 124.152 0.981 . . . . 0.0 111.336 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -62.42 -42.31 99.35 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.574 0.749 . . . . 0.0 111.908 175.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -69.52 -22.56 63.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.267 0.627 . . . . 0.0 111.273 173.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -89.1 -0.28 57.31 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.446 0.698 . . . . 0.0 111.309 173.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 65.48 11.17 7.19 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 125.027 1.331 . . . . 0.0 112.43 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.492 ' HB3' HD23 ' A' ' 25' ' ' LEU . 96.7 mttt -74.53 -34.82 63.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.869 0.868 . . . . 0.0 111.2 -178.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.427 HG11 ' HE2' ' A' ' 58' ' ' MET . 24.4 m -128.9 147.07 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.229 0.612 . . . . 0.0 109.637 175.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 65' ' ' SER . . . . . 0.62 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 49.0 m -121.0 156.28 32.48 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.962 0.905 . . . . 0.0 109.459 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.7 tp -104.17 103.31 13.07 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.7 t -95.68 -36.4 11.22 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.366 0.666 . . . . 0.0 111.127 -169.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.57 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.1 m -139.34 166.8 21.89 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 123.584 0.754 . . . . 0.0 109.469 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -51.06 106.92 0.15 Allowed 'Trans proline' 0 C--N 1.39 2.731 0 C-N-CA 123.177 2.585 . . . . 0.0 113.195 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 66.11 21.31 11.19 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.569 1.148 . . . . 0.0 111.933 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.57 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 29.2 m -120.14 122.75 41.71 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 123.937 0.895 . . . . 0.0 108.771 -177.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -106.99 169.01 8.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.62 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 24.6 p -150.74 158.49 44.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.59 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 18.7 tp -78.26 105.07 9.25 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.033 0 O-C-N 123.843 0.715 . . . . 0.0 111.327 176.774 . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 . . . . . . . . . 0 0 . 1 . 014 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -69.81 -40.27 75.47 Favored Glycine 0 C--N 1.35 1.33 0 N-CA-C 115.541 0.976 . . . . 0.0 115.541 177.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -72.89 -37.95 67.13 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.006 0.908 . . . . 0.0 110.149 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.571 HD13 HD23 ' A' ' 51' ' ' LEU . 3.0 tm? -66.15 -36.43 83.11 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 113.378 -1.737 . . . . 0.0 110.156 174.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.416 ' HG3' ' HG2' ' A' ' 58' ' ' MET . 34.6 tt0 -60.64 -46.16 91.35 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.316 1.046 . . . . 0.0 110.32 174.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 69.8 mt-30 -65.98 -32.62 74.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.438 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.492 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -66.74 -48.66 68.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.48 0.712 . . . . 0.0 109.353 176.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.435 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.2 mt -57.65 -49.17 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 124.275 0.984 . . . . 0.0 109.878 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.49 HD23 ' HB3' ' A' ' 63' ' ' LYS . 78.2 mt -55.8 -40.15 72.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 123.596 0.758 . . . . 0.0 110.832 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -70.87 -41.48 71.31 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 123.865 0.728 . . . . 0.0 110.692 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 23' ' ' ARG . 60.5 t -54.69 -46.34 73.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.298 0.639 . . . . 0.0 110.221 174.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 71.2 mt -65.26 -39.76 93.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.253 -178.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -69.58 -48.48 60.04 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.279 1.032 . . . . 0.0 112.043 -177.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.99 -36.15 81.54 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.616 0.766 . . . . 0.0 110.237 -176.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.73 87.51 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.782 171.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 24.31 70.34 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.951 -171.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -153.35 149.56 21.75 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.413 1.085 . . . . 0.0 109.36 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -55.17 114.66 1.97 Allowed 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.533 2.156 . . . . 0.0 112.277 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . 0.43 HG23 HG11 ' A' ' 27' ' ' VAL . 91.7 t -96.04 131.5 42.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.777 0.831 . . . . 0.0 108.924 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 46.2 mtpt -73.12 151.27 41.66 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.04 0.536 . . . . 0.0 109.943 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.472 ' O ' HG23 ' A' ' 41' ' ' VAL . 36.2 tp -54.09 -44.74 71.47 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.394 1.058 . . . . 0.0 111.199 178.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.89 -49.18 11.11 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.043 0.937 . . . . 0.0 112.627 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.412 ' HA ' ' HG2' ' A' ' 42' ' ' LYS . 52.1 tt0 -77.07 -28.18 54.55 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.595 0.358 . . . . 0.0 110.807 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.14 -32.27 73.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.336 0.255 . . . . 0.0 110.358 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.535 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.2 t -59.68 -55.44 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.302 0.641 . . . . 0.0 110.786 175.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HG2' ' HA ' ' A' ' 39' ' ' GLN . 20.3 ptmt -69.9 -42.26 73.63 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.601 -174.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -72.47 -36.25 68.41 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.8 m -83.75 -17.04 42.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 117.866 0.303 . . . . 0.0 111.443 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 58.94 27.53 16.4 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.533 1.133 . . . . 0.0 111.82 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.68 154.9 54.98 Favored Pre-proline 0 C--O 1.245 0.854 0 C-N-CA 124.283 1.033 . . . . 0.0 109.963 -174.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.43 131.13 30.66 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.504 2.136 . . . . 0.0 111.864 177.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HA ' HD13 ' A' ' 51' ' ' LEU . 40.5 ttmt -45.23 -41.05 8.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.486 1.515 . . . . 0.0 113.239 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -53.81 -49.4 68.45 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.816 0.846 . . . . 0.0 111.264 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.97 -44.25 96.56 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 123.467 0.707 . . . . 0.0 110.773 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.571 HD23 HD13 ' A' ' 20' ' ' LEU . 75.1 mt -54.73 -51.07 66.78 Favored 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.513 1.133 . . . . 0.0 110.671 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.38 -54.73 23.61 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.257 0.973 . . . . 0.0 112.311 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -53.57 -44.89 69.68 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.657 HG11 ' SD ' ' A' ' 58' ' ' MET . 94.8 t -66.37 -51.1 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 122.869 0.467 . . . . 0.0 110.789 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.429 HD11 ' NE1' ' A' ' 72' ' ' TRP . 57.7 mt -48.63 -49.62 36.39 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.509 1.524 . . . . 0.0 114.537 -176.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -69.35 -29.43 67.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.451 0.301 . . . . 0.0 111.421 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -67.57 -47.76 68.86 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 174.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.657 ' SD ' HG11 ' A' ' 54' ' ' VAL . 73.2 mtp -60.58 -34.06 73.62 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.908 0.883 . . . . 0.0 110.927 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -64.78 -42.62 94.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.748 0.819 . . . . 0.0 110.82 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -59.91 -44.05 94.51 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.74 0.816 . . . . 0.0 110.423 172.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -78.92 -1.28 34.5 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.469 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt 62.93 15.72 8.58 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 125.343 1.457 . . . . 0.0 112.28 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.49 ' HB3' HD23 ' A' ' 25' ' ' LEU . 92.4 mttt -67.96 -33.24 74.27 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.573 1.149 . . . . 0.0 109.868 173.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.492 HG11 ' HE2' ' A' ' 58' ' ' MET . 28.9 m -129.1 169.43 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.265 0.626 . . . . 0.0 109.451 173.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.9 t -134.05 147.32 50.91 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 176.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.4 tp -100.54 106.28 17.78 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 35.1 p -93.7 -34.29 13.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.636 0.774 . . . . 0.0 111.772 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.675 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 47.6 t -141.15 154.65 68.07 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -21.68 -67.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.394 2.957 1 C-N-CA 125.594 4.196 . . . . 0.0 116.513 -177.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.08 51.69 1.42 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.489 0.661 . . . . 0.0 110.538 173.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.675 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 69.3 m -131.87 128.57 38.9 Favored 'General case' 0 C--O 1.243 0.711 0 C-N-CA 123.647 0.779 . . . . 0.0 109.541 172.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . 0.429 ' NE1' HD11 ' A' ' 55' ' ' LEU . 75.2 m95 -117.67 142.22 47.49 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.789 0.836 . . . . 0.0 109.701 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 38.7 t -115.87 166.31 12.11 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.585 0.754 . . . . 0.0 109.848 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.83 129.6 40.39 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.708 0.803 . . . . 0.0 109.428 174.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.684 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 175.821 . . . . . . . . 0 0 . 1 . 015 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 . . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -51.51 -38.22 42.44 Favored Glycine 0 C--N 1.346 1.117 0 O-C-N 123.77 0.669 . . . . 0.0 114.442 177.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -83.39 -32.62 26.07 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.393 0.277 . . . . 0.0 110.817 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.555 HD11 ' HA ' ' A' ' 51' ' ' LEU . 0.8 OUTLIER -60.35 -53.11 61.54 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.454 1.102 . . . . 0.0 108.937 178.433 . . . . . . . . 3 3 . 1 . 015 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.756 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.6 tt0 -59.48 -47.46 85.41 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.551 176.011 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -41.18 94.17 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 123.784 0.678 . . . . 0.0 109.963 -173.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.51 -49.62 70.62 Favored 'General case' 0 C--N 1.346 0.426 0 C-N-CA 123.666 0.787 . . . . 0.0 111.968 -178.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 76.1 mt -58.62 -49.52 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 124.056 0.848 . . . . 0.0 110.152 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.51 -38.76 91.18 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 123.586 0.754 . . . . 0.0 111.286 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -70.92 -41.41 71.25 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.47 0.481 . . . . 0.0 110.573 -176.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.7 t -63.31 -37.52 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.105 0.562 . . . . 0.0 110.338 176.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.51 HD22 ' HA ' ' A' ' 73' ' ' CYS . 89.5 mt -71.09 -28.94 64.7 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.767 0.427 . . . . 0.0 111.123 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 99.0 m -73.6 -49.58 25.49 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.048 0.939 . . . . 0.0 111.632 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -66.85 -32.08 73.11 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.158 0.583 . . . . 0.0 110.572 -176.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.32 -47.73 80.98 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.918 169.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.66 27.29 69.61 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.975 0.797 . . . . 0.0 111.332 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.4 t -160.5 151.13 15.29 Favored Pre-proline 0 C--O 1.245 0.86 0 C-N-CA 124.478 1.111 . . . . 0.0 109.238 -166.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -56.52 123.83 14.78 Favored 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 122.738 2.292 . . . . 0.0 112.209 172.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 88.0 t -113.62 137.21 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.475 1.11 . . . . 0.0 108.61 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 95.1 mttt -75.1 148.56 39.62 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 123.221 0.608 . . . . 0.0 109.456 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 41' ' ' VAL . 45.6 tp -54.01 -43.09 69.77 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 124.544 1.152 . . . . 0.0 111.013 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -43.2 -51.06 6.25 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.502 1.121 . . . . 0.0 113.184 170.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -74.42 -30.91 62.11 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.931 0.493 . . . . 0.0 110.84 -179.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 37' ' ' LEU . 97.0 mt -61.83 -33.6 74.44 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.897 0.479 . . . . 0.0 110.192 175.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 37' ' ' LEU . 60.9 t -59.38 -55.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.609 0.764 . . . . 0.0 111.738 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -68.67 -41.98 78.52 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 123.853 0.721 . . . . 0.0 111.003 -174.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -67.81 -48.17 67.03 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.208 0.603 . . . . 0.0 112.03 -178.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 63.6 m -77.83 -13.67 59.81 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.004 0.521 . . . . 0.0 111.325 -177.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 57.69 40.57 26.39 Favored 'General case' 0 C--N 1.364 1.203 0 C-N-CA 124.253 1.021 . . . . 0.0 110.407 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.487 ' HB2' HD22 ' A' ' 51' ' ' LEU . . . -138.6 154.29 73.14 Favored Pre-proline 0 CA--C 1.553 1.075 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.599 -172.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -60.61 129.06 27.88 Favored 'Trans proline' 0 C--N 1.381 2.269 0 C-N-CA 123.198 2.598 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -41.0 -48.82 3.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.178 1.391 . . . . 0.0 114.08 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 82.1 mtm180 -59.24 -45.45 91.13 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 123.87 0.731 . . . . 0.0 111.061 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.06 -46.28 81.83 Favored 'General case' 0 C--O 1.241 0.622 0 O-C-N 123.957 0.786 . . . . 0.0 109.661 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.555 ' HA ' HD11 ' A' ' 20' ' ' LEU . 81.3 mt -56.1 -49.86 72.66 Favored 'General case' 0 C--N 1.356 0.874 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.927 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.405 ' HA ' HD13 ' A' ' 55' ' ' LEU . 22.2 t-20 -63.15 -43.4 98.42 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.385 1.053 . . . . 0.0 112.698 -173.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 78.8 mm-40 -60.97 -45.39 94.97 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 120.573 0.225 . . . . 0.0 111.058 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.5 t -66.17 -38.33 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.341 0.656 . . . . 0.0 110.705 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 52' ' ' ASN . 14.7 mt -53.1 -39.64 63.54 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.684 1.193 . . . . 0.0 112.767 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -68.03 -35.31 78.06 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 118.417 0.553 . . . . 0.0 112.033 179.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.484 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 66.1 ttp85 -68.01 -50.34 56.07 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.756 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 69.6 mtm -62.27 -28.39 69.68 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.989 0.806 . . . . 0.0 111.678 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -71.84 -38.91 70.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -63.44 -39.91 95.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.304 0.642 . . . . 0.0 110.414 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.33 -2.54 45.8 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.759 0.824 . . . . 0.0 111.436 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.1 mt 68.59 10.33 7.82 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.155 1.382 . . . . 0.0 112.529 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.555 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 64.5 mttm -64.66 -32.02 73.5 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.875 0.87 . . . . 0.0 110.416 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 18.5 m -130.62 165.37 31.1 Favored 'Isoleucine or valine' 0 C--O 1.245 0.834 0 C-N-CA 124.106 0.962 . . . . 0.0 109.115 172.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 t -143.44 145.13 32.36 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.5 tp -95.7 103.88 15.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.151 0.58 . . . . 0.0 109.546 -172.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 33.5 p -84.16 -45.62 12.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.572 0.749 . . . . 0.0 112.082 -174.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.511 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 17.8 m -132.29 169.43 13.91 Favored Pre-proline 0 N--CA 1.479 0.999 0 CA-C-O 117.44 -1.267 . . . . 0.0 107.587 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 2.3 Cg_exo -29.09 -78.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 124.689 3.593 . . . . 0.0 115.266 178.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -100.18 19.52 16.31 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 118.89 0.768 . . . . 0.0 112.026 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.511 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 20.6 m -107.97 125.85 52.01 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.134 0.492 . . . . 0.0 109.859 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.16 168.35 10.19 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.51 ' HA ' HD22 ' A' ' 28' ' ' LEU . 35.4 t -149.06 164.41 34.72 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.1 tp -65.98 143.82 57.14 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.529 0.518 . . . . 0.0 109.724 175.898 . . . . . . . . 1 1 . 1 . 015 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 0.993 0 O-C-N 123.649 0.593 . . . . 0.0 113.249 178.691 . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 N--CA 1.489 1.486 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 . . . . . . . . . 0 0 . 1 . 016 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . 0.443 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -66.3 -27.59 73.13 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-O 120.145 -0.253 . . . . 0.0 113.315 177.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -73.76 -35.15 64.97 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.637 0.775 . . . . 0.0 109.163 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.508 HD12 ' HA ' ' A' ' 51' ' ' LEU . 2.8 tm? -66.88 -39.36 87.46 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.784 1.634 . . . . 0.0 108.978 176.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -66.71 -38.44 86.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.965 0.906 . . . . 0.0 110.202 177.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 56.0 mt-30 -62.69 -40.19 96.33 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.879 0.872 . . . . 0.0 110.455 174.228 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -68.52 -42.87 77.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 123.614 0.766 . . . . 0.0 111.599 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.1 mt -58.89 -52.3 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 123.827 0.705 . . . . 0.0 109.361 177.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.584 HD23 ' HB3' ' A' ' 63' ' ' LYS . 91.5 mt -58.27 -40.47 81.95 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.493 0.717 . . . . 0.0 111.367 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -67.48 -49.07 65.18 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.468 0.707 . . . . 0.0 111.092 -177.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.44 -39.49 79.29 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.534 1.134 . . . . 0.0 111.349 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 73' ' ' CYS . 85.7 mt -67.89 -40.02 83.58 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.875 0.87 . . . . 0.0 110.915 176.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -68.48 -48.83 63.46 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.999 0.919 . . . . 0.0 111.426 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -71.42 -39.51 71.03 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 123.182 0.593 . . . . 0.0 110.95 -173.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.6 -33.63 75.38 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.505 0.503 . . . . 0.0 111.059 173.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.36 32.52 84.47 Favored Glycine 0 C--N 1.354 1.542 0 O-C-N 123.959 0.787 . . . . 0.0 112.771 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 p -170.31 155.86 5.31 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 124.192 0.997 . . . . 0.0 109.141 -171.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.567 ' HB3' ' HB2' ' A' ' 73' ' ' CYS . 20.2 Cg_endo -60.92 118.26 5.11 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.728 2.285 . . . . 0.0 112.998 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.79 135.66 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -66.11 143.75 57.12 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.511 0.724 . . . . 0.0 109.986 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.474 HD13 HD13 ' A' ' 55' ' ' LEU . 13.1 tp -61.26 -41.77 97.49 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.912 0.885 . . . . 0.0 110.67 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.5 -41.91 10.13 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.094 0.957 . . . . 0.0 113.42 167.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 27.4 tt0 -82.89 -29.45 29.27 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.409 ' O ' ' SG ' ' A' ' 44' ' ' CYS . 78.1 mt -60.05 -34.63 73.67 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 37' ' ' LEU . 91.5 t -51.8 -56.32 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 124.708 1.203 . . . . 0.0 111.701 175.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -71.53 -37.51 71.17 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.181 -173.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 9.1 mm-40 -61.38 -53.11 60.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.03 0.532 . . . . 0.0 111.704 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.492 ' SG ' ' HB2' ' A' ' 46' ' ' ALA . 30.4 p -83.93 -10.32 58.05 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.113 0.565 . . . . 0.0 111.127 -176.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 63.67 17.59 10.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.623 1.169 . . . . 0.0 111.797 -178.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.492 ' HB2' ' SG ' ' A' ' 44' ' ' CYS . . . -107.98 151.84 41.45 Favored Pre-proline 0 N--CA 1.476 0.828 0 C-N-CA 124.134 0.974 . . . . 0.0 110.867 -175.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.3 140.24 81.82 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.548 2.165 . . . . 0.0 111.575 175.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -47.1 -34.32 5.88 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 124.19 0.996 . . . . 0.0 112.553 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . 0.431 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 20.4 tpp180 -61.82 -47.38 85.33 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.241 0.616 . . . . 0.0 111.779 177.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -62.66 -47.31 84.26 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 123.326 0.65 . . . . 0.0 110.249 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.508 ' HA ' HD12 ' A' ' 20' ' ' LEU . 17.3 mt -53.34 -56.46 16.53 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 124.62 1.168 . . . . 0.0 110.893 176.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -49.21 -52.53 26.31 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 126.091 1.757 . . . . 0.0 111.868 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 14.3 mm100 -53.42 -47.99 69.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.945 0.898 . . . . 0.0 111.667 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.497 HG22 HD11 ' A' ' 20' ' ' LEU . 85.1 t -68.32 -44.89 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.25 -179.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.474 HD13 HD13 ' A' ' 37' ' ' LEU . 54.6 mt -52.32 -44.51 65.14 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.496 1.518 . . . . 0.0 114.306 -177.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -62.89 -32.45 73.71 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.202 0.456 . . . . 0.0 111.071 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.454 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.5 mmm-85 -70.68 -49.17 50.09 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 123.03 0.532 . . . . 0.0 109.768 177.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.47 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 70.7 mtp -57.77 -36.12 71.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.114 0.966 . . . . 0.0 111.618 -177.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -59.4 -44.04 92.87 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.427 0.691 . . . . 0.0 110.246 176.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -75.29 -25.33 57.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.502 1.121 . . . . 0.0 111.81 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 7.0 mm-40 -77.83 -4.65 47.63 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.041 0.536 . . . . 0.0 110.001 170.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 83.1 mt 68.32 19.19 9.04 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 125.541 1.536 . . . . 0.0 111.438 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.584 ' HB3' HD23 ' A' ' 25' ' ' LEU . 98.8 mttt -80.72 -33.42 35.26 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.782 1.233 . . . . 0.0 111.711 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.9 m -132.74 161.75 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-O 121.267 0.556 . . . . 0.0 111.189 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.6 t -132.31 145.34 51.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.904 1.281 . . . . 0.0 108.61 174.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 47.0 tp -95.67 109.01 21.35 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 37.3 p -84.78 -44.57 13.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.161 0.584 . . . . 0.0 111.168 -175.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.665 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 13.1 m -134.72 159.5 71.93 Favored Pre-proline 0 CA--C 1.555 1.141 0 CA-C-O 117.212 -1.375 . . . . 0.0 107.64 -175.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -29.68 -66.02 0.07 OUTLIER 'Trans proline' 0 C--N 1.396 3.059 0 C-N-CA 125.017 3.811 . . . . 0.0 116.243 -174.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.65 40.07 3.02 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.924 0.889 . . . . 0.0 111.084 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.665 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 91.1 m -131.2 122.82 27.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.606 0.762 . . . . 0.0 109.869 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.5 m95 -114.25 151.47 32.79 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.119 0.968 . . . . 0.0 108.698 -172.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.567 ' HB2' ' HB3' ' A' ' 34' ' ' PRO . 42.7 t -132.54 170.26 15.41 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.053 0.941 . . . . 0.0 109.209 177.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.0 tp -68.49 160.31 30.06 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.313 0 C-N-CA 122.74 0.209 . . . . 0.0 112.722 179.512 . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 121.065 0.46 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 017 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.72 -30.27 72.74 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.643 -1.162 . . . . 0.0 113.458 179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -74.68 -39.1 62.2 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.495 HD12 HG21 ' A' ' 54' ' ' VAL . 2.4 tm? -65.11 -40.87 95.15 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.444 1.098 . . . . 0.0 110.403 173.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.731 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 19.5 tt0 -58.28 -49.97 75.26 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.313 1.445 . . . . 0.0 110.974 175.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -66.32 -31.6 72.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.916 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 20.6 tpp180 -62.74 -47.15 84.82 Favored 'General case' 0 C--N 1.351 0.637 0 C-N-CA 122.944 0.498 . . . . 0.0 110.553 174.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 20' ' ' LEU . 68.6 mt -60.09 -46.94 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.859 0.725 . . . . 0.0 109.9 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.464 HD12 ' HD3' ' A' ' 63' ' ' LYS . 93.2 mt -62.16 -35.89 80.17 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.547 0.739 . . . . 0.0 110.97 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . 0.504 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 29.8 tt0 -70.28 -44.66 67.94 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.885 0.741 . . . . 0.0 110.567 178.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.8 t -54.23 -44.59 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.979 0.912 . . . . 0.0 110.938 174.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.9 mt -66.26 -37.45 85.51 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -64.22 -51.16 65.01 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.167 0.987 . . . . 0.0 111.605 177.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 15.7 mm-40 -63.29 -46.6 86.0 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.223 0.609 . . . . 0.0 111.444 -173.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.95 -38.29 90.46 Favored 'General case' 0 C--O 1.24 0.578 0 O-C-N 124.177 0.923 . . . . 0.0 110.573 178.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.57 -56.8 4.91 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.142 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.1 p -72.58 161.92 76.72 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 124.12 0.968 . . . . 0.0 110.835 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -50.41 142.59 29.5 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.982 2.455 . . . . 0.0 113.368 172.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 39.6 t -121.79 132.1 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.731 0.812 . . . . 0.0 109.426 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -69.96 148.42 48.94 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.04 0.536 . . . . 0.0 109.806 176.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HG ' ' HG3' ' A' ' 48' ' ' LYS . 38.7 tp -60.78 -45.26 95.05 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.679 1.192 . . . . 0.0 110.494 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.63 -37.66 18.82 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.334 1.054 . . . . 0.0 113.509 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -82.48 -28.84 30.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.64 0.376 . . . . 0.0 110.908 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.403 HD11 ' HA ' ' A' ' 37' ' ' LEU . 94.3 mt -60.55 -32.36 71.43 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 122.458 0.303 . . . . 0.0 110.219 174.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.8 t -56.59 -56.21 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 123.945 0.898 . . . . 0.0 111.789 176.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -64.22 -47.08 81.08 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.591 0.557 . . . . 0.0 110.961 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.74 -48.11 82.17 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.453 0.701 . . . . 0.0 112.788 -178.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 64.4 m -82.67 -12.29 57.73 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.663 0.385 . . . . 0.0 111.971 -176.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 57.23 31.4 20.0 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.779 0.832 . . . . 0.0 111.866 -179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . 0.422 ' HB2' HD22 ' A' ' 51' ' ' LEU . . . -125.14 154.61 71.68 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.727 -174.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . 0.448 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 31.1 Cg_endo -62.22 132.31 38.28 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 121.851 1.701 . . . . 0.0 110.961 175.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG3' ' HG ' ' A' ' 37' ' ' LEU . 40.5 ttmt -40.01 -43.99 1.66 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.976 1.31 . . . . 0.0 113.42 174.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -58.48 -42.3 87.2 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.182 0.993 . . . . 0.0 112.125 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . 0.448 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 10.0 tp10 -64.64 -50.18 68.12 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.698 0.799 . . . . 0.0 109.831 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 46' ' ' ALA . 51.8 mt -59.42 -54.62 44.59 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.211 1.005 . . . . 0.0 111.503 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . 0.505 ' HA ' HD12 ' A' ' 55' ' ' LEU . 58.2 t30 -50.87 -51.2 53.91 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.282 1.833 . . . . 0.0 112.072 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.6 -43.55 98.52 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 123.729 0.643 . . . . 0.0 111.332 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.495 HG21 HD12 ' A' ' 20' ' ' LEU . 83.1 t -65.54 -35.61 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 52' ' ' ASN . 30.9 mt -56.94 -37.54 71.66 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.105 0.962 . . . . 0.0 112.82 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -70.03 -33.43 71.97 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.766 0.712 . . . . 0.0 111.085 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -70.72 -48.25 55.57 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.731 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 74.9 mtm -64.4 -29.11 70.18 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.857 0.863 . . . . 0.0 111.679 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -63.45 -40.98 98.6 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.053 0.541 . . . . 0.0 110.562 175.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -71.46 -25.3 62.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.283 0.633 . . . . 0.0 111.135 176.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -85.0 -2.53 58.07 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.283 0.633 . . . . 0.0 111.647 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 66.58 17.1 10.57 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.922 1.289 . . . . 0.0 112.469 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.537 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 96.6 mttt -73.2 -38.61 66.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.043 0.937 . . . . 0.0 110.99 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.404 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 18.6 m -127.1 164.41 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.451 0.7 . . . . 0.0 110.14 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.5 m -144.91 151.66 39.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.0 tp -96.03 101.61 13.29 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.6 p -84.69 -41.78 15.93 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.544 0.738 . . . . 0.0 111.557 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.454 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 49.1 m -134.93 167.77 21.12 Favored Pre-proline 0 N--CA 1.481 1.124 0 C-N-CA 123.751 0.82 . . . . 0.0 109.64 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.98 110.78 0.41 Allowed 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 122.976 2.451 . . . . 0.0 112.867 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.8 33.73 17.6 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.982 1.313 . . . . 0.0 111.56 -178.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.454 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 51.0 m -129.67 121.76 27.62 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -118.45 142.47 47.53 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.275 1.03 . . . . 0.0 108.315 -174.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 33.7 t -130.4 165.74 21.94 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 30.2 tp -74.61 102.53 4.6 Favored 'General case' 0 C--O 1.24 0.584 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . 0.404 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . . . . . . 0 C--N 1.34 0.794 0 O-C-N 123.896 0.748 . . . . 0.0 111.524 -178.313 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.429 0.156 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 018 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.9 -44.2 89.55 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 124.045 0.841 . . . . 0.0 114.762 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -70.67 -39.6 73.48 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.929 0.864 . . . . 0.0 110.972 -175.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.442 ' O ' HG13 ' A' ' 24' ' ' ILE . 2.4 tm? -64.98 -40.29 94.75 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.348 0.659 . . . . 0.0 110.1 174.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -58.66 -47.76 83.37 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.295 1.038 . . . . 0.0 111.395 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -36.88 82.8 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.039 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.4 ' O ' HG21 ' A' ' 27' ' ' VAL . 16.4 tpt180 -67.41 -41.63 84.56 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.083 0.553 . . . . 0.0 111.011 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.459 ' HB ' ' HE2' ' A' ' 58' ' ' MET . 79.4 mt -60.28 -52.93 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 122.836 0.454 . . . . 0.0 110.432 176.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.18 -32.68 72.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.503 0.721 . . . . 0.0 111.09 -178.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -63.55 -52.13 62.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.354 1.061 . . . . 0.0 109.926 176.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.4 HG21 ' O ' ' A' ' 23' ' ' ARG . 76.1 t -58.2 -41.86 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.966 0.906 . . . . 0.0 110.591 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 97.5 mt -69.88 -36.0 75.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.302 0.641 . . . . 0.0 111.695 -177.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -70.44 -45.04 66.61 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.359 0.663 . . . . 0.0 111.861 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -71.81 -33.42 68.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.948 0.499 . . . . 0.0 111.326 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.79 68.98 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 168.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.84 26.53 67.2 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.643 -175.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.1 t -152.53 150.6 25.3 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.262 1.025 . . . . 0.0 109.028 -171.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.19 125.11 15.49 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.675 2.25 . . . . 0.0 113.32 173.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.94 132.8 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.143 0.977 . . . . 0.0 108.521 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 54.7 mtpt -64.35 151.7 43.24 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.492 0.717 . . . . 0.0 111.19 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.407 ' O ' HG21 ' A' ' 41' ' ' VAL . 51.9 tp -62.4 -50.51 71.26 Favored 'General case' 0 C--N 1.356 0.855 0 O-C-N 123.424 0.452 . . . . 0.0 109.852 176.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.03 -37.95 10.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.99 0.916 . . . . 0.0 112.848 170.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . 0.402 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 61.6 tt0 -78.31 -34.66 48.57 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.253 0.621 . . . . 0.0 110.619 -179.475 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 66.9 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.601 0.761 . . . . 0.0 110.815 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.407 HG21 ' O ' ' A' ' 37' ' ' LEU . 35.8 t -55.49 -50.88 63.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.37 0.668 . . . . 0.0 111.706 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -76.26 -43.62 41.05 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.986 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -59.59 -56.51 20.96 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.274 0.488 . . . . 0.0 112.039 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 62.7 m -72.74 -8.39 55.16 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.827 0.451 . . . . 0.0 111.632 -177.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 61.9 22.87 13.37 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.017 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.84 149.01 58.35 Favored Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.92 -164.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.47 133.14 29.2 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.508 2.139 . . . . 0.0 111.761 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -42.15 -36.14 1.11 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.734 1.613 . . . . 0.0 112.934 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.9 ttm105 -54.6 -56.62 17.09 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.355 1.062 . . . . 0.0 112.21 176.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -44.75 79.53 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.873 -176.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.7 mt -55.37 -59.71 4.43 Favored 'General case' 0 C--O 1.212 -0.881 0 O-C-N 124.082 0.864 . . . . 0.0 111.093 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -48.4 -56.12 9.01 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.278 1.431 . . . . 0.0 112.089 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.33 -52.61 64.63 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.779 0.832 . . . . 0.0 112.101 -177.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.54 HG12 ' SD ' ' A' ' 58' ' ' MET . 97.4 t -67.05 -38.0 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 122.821 0.448 . . . . 0.0 110.204 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . 0.444 HD21 HG23 ' A' ' 24' ' ' ILE . 17.4 mt -54.06 -40.38 67.1 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.685 1.194 . . . . 0.0 114.137 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -71.76 -24.32 61.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 119.436 1.016 . . . . 0.0 111.365 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -73.61 -48.82 29.76 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.54 ' SD ' HG12 ' A' ' 54' ' ' VAL . 66.0 mtp -60.68 -37.74 82.64 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.603 1.161 . . . . 0.0 111.476 179.3 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -58.51 -45.97 87.69 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.424 1.09 . . . . 0.0 110.599 175.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . 0.551 ' HZ2' ' HB2' ' A' ' 60' ' ' LYS . 4.3 ttmp? -72.77 -26.45 61.54 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.096 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -85.52 -2.17 57.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.831 0.852 . . . . 0.0 111.265 174.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 69.95 12.17 7.81 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.978 1.311 . . . . 0.0 112.306 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.411 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 94.4 mttt -70.03 -37.13 75.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.726 0.81 . . . . 0.0 110.792 175.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.432 HG11 ' HE1' ' A' ' 58' ' ' MET . 22.2 m -131.25 175.77 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.3 t -144.13 158.13 43.9 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 30.5 tp -109.56 113.16 25.72 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 175.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.6 p -100.47 -31.95 11.04 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.572 0.749 . . . . 0.0 111.283 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.692 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 39.2 t -139.23 148.37 56.82 Favored Pre-proline 0 CA--C 1.552 1.035 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -26.0 -72.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.39 2.739 1 C-N-CA 125.407 4.071 . . . . 0.0 116.721 -172.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.84 39.34 2.4 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.345 0.658 . . . . 0.0 111.008 177.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.692 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 86.2 m -131.27 123.02 27.48 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.801 0.84 . . . . 0.0 109.239 176.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -104.51 160.34 15.01 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.622 -173.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 51.8 t -138.63 156.17 47.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . 0.471 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 35.7 tp -76.21 131.03 39.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.393 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.924 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 178.377 . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 110.517 -0.179 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 019 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.05 -32.06 81.31 Favored Glycine 0 C--N 1.342 0.865 0 O-C-N 123.5 0.5 . . . . 0.0 113.369 174.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -65.58 -45.28 83.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.439 0.638 . . . . 0.0 109.403 176.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.567 HD13 HG21 ' A' ' 54' ' ' VAL . 2.3 tm? -67.4 -37.63 83.4 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 113.943 -1.481 . . . . 0.0 111.404 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.473 ' HG3' ' HE1' ' A' ' 58' ' ' MET . 38.9 tt0 -65.18 -43.19 92.48 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.015 0.926 . . . . 0.0 110.709 176.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -66.9 -34.42 77.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.753 175.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.477 ' HB3' ' HA ' ' A' ' 44' ' ' CYS . 0.6 OUTLIER -59.48 -52.7 64.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.234 0.614 . . . . 0.0 110.791 174.185 . . . . . . . . 3 3 . 1 . 019 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.466 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.3 mt -55.57 -48.81 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 O-C-N 124.251 0.969 . . . . 0.0 110.449 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.545 HD21 ' HB3' ' A' ' 63' ' ' LYS . 89.0 mt -62.56 -37.14 84.99 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.217 0.607 . . . . 0.0 111.568 -178.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -66.74 -47.92 70.77 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.743 0.652 . . . . 0.0 110.465 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.495 HG22 ' SG ' ' A' ' 44' ' ' CYS . 85.2 t -56.79 -40.49 71.1 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.153 0.981 . . . . 0.0 110.885 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 93.4 mt -69.47 -38.82 77.88 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.069 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.2 m -69.37 -45.97 68.07 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.546 0.738 . . . . 0.0 111.677 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -68.88 -34.83 76.08 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.437 0.695 . . . . 0.0 110.613 -176.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.76 83.23 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.7 171.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.7 28.89 68.76 Favored Glycine 0 C--N 1.352 1.429 0 O-C-N 123.946 0.779 . . . . 0.0 111.853 -171.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.5 t -162.19 147.51 10.13 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.41 1.084 . . . . 0.0 109.057 -165.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . 0.424 ' HG3' ' HB2' ' A' ' 73' ' ' CYS . 74.3 Cg_exo -51.86 114.77 1.75 Allowed 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 123.163 2.575 . . . . 0.0 113.757 174.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.1 t -96.37 146.75 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.056 0.942 . . . . 0.0 109.691 179.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -82.01 152.56 26.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.505 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.425 ' HA ' HD11 ' A' ' 40' ' ' LEU . 39.1 tp -57.61 -49.46 76.35 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.517 1.127 . . . . 0.0 111.053 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.66 -32.58 42.9 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -83.88 -27.48 28.62 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.959 0.409 . . . . 0.0 110.199 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . 0.425 HD11 ' HA ' ' A' ' 37' ' ' LEU . 91.6 mt -65.64 -28.65 69.26 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.581 0.753 . . . . 0.0 110.504 174.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.572 ' HA ' HD11 ' A' ' 51' ' ' LEU . 91.8 t -56.21 -52.3 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.004 0.522 . . . . 0.0 111.926 -178.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -71.5 -50.73 28.65 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 123.561 0.538 . . . . 0.0 111.166 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.9 -49.38 46.44 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 123.492 0.717 . . . . 0.0 111.391 -172.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . 0.495 ' SG ' HG22 ' A' ' 27' ' ' VAL . 54.6 m -76.46 -11.7 59.92 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.511 0.324 . . . . 0.0 111.276 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 62.85 51.3 3.01 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.266 1.026 . . . . 0.0 111.644 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -149.74 152.06 33.97 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 123.007 0.523 . . . . 0.0 110.652 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.83 145.92 94.85 Favored 'Trans proline' 0 C--N 1.366 1.5 0 C-N-CA 122.496 2.131 . . . . 0.0 111.727 173.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.53 ' HZ1' ' HB2' ' A' ' 48' ' ' LYS . 4.6 ttmp? -39.44 -56.58 1.58 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.87 1.268 . . . . 0.0 113.735 177.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -58.11 -36.37 72.8 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.94 -48.3 74.57 Favored 'General case' 0 C--O 1.245 0.853 0 O-C-N 123.54 0.525 . . . . 0.0 109.978 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.572 HD11 ' HA ' ' A' ' 41' ' ' VAL . 57.3 mt -55.35 -53.25 58.49 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 124.521 1.138 . . . . 0.0 111.52 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -49.76 -50.1 45.82 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 124.383 1.052 . . . . 0.0 112.285 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -56.79 -46.52 81.5 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 124.313 1.008 . . . . 0.0 111.067 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.567 HG21 HD13 ' A' ' 20' ' ' LEU . 54.0 t -70.32 -43.16 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.877 0.471 . . . . 0.0 110.835 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.8 mt -51.9 -49.67 62.57 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.03 1.332 . . . . 0.0 114.078 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -71.69 -26.31 62.46 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 118.08 0.4 . . . . 0.0 110.927 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.8 tmt_? -68.43 -52.28 34.52 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.479 0.711 . . . . 0.0 109.431 174.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.499 ' SD ' HG12 ' A' ' 54' ' ' VAL . 83.3 mtp -61.11 -29.25 69.65 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.695 1.198 . . . . 0.0 111.498 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -63.78 -41.96 97.86 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.944 0.497 . . . . 0.0 110.575 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -71.49 -28.55 64.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 123.83 0.706 . . . . 0.0 110.758 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.01 -2.65 45.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.125 0.57 . . . . 0.0 110.921 173.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 74.4 mt 63.88 16.11 9.6 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.036 1.334 . . . . 0.0 112.115 178.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.545 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.9 mttt -77.06 -32.46 56.85 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.257 1.023 . . . . 0.0 110.637 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . 0.494 HG11 ' HE2' ' A' ' 58' ' ' MET . 22.0 m -129.51 164.18 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 26.7 t -137.11 148.25 46.56 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.0 tp -100.57 106.58 18.1 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 11.6 p -88.18 -43.97 11.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.902 0.881 . . . . 0.0 111.063 -176.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.41 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 34.3 t -140.73 153.71 68.14 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -177.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.02 112.75 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.528 0 C-N-CA 123.235 2.623 . . . . 0.0 114.608 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 68.73 20.41 8.17 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.856 1.262 . . . . 0.0 112.075 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 71' ' ' THR . . . . . 0.41 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 6.2 m -126.04 115.48 19.93 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -115.99 142.98 46.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.712 0.805 . . . . 0.0 109.797 -167.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . 0.424 ' HB2' ' HG3' ' A' ' 34' ' ' PRO . 53.4 t -113.94 161.47 17.6 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 123.223 0.609 . . . . 0.0 110.213 177.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.58 102.38 0.9 Allowed 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.924 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.647 -178.589 . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 . . . . . 0 N--CA 1.483 1.18 0 CA-C-O 119.477 -0.297 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 020 nuclear orig core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.62 -32.82 61.29 Favored Glycine 0 C--N 1.347 1.174 0 O-C-N 124.262 0.976 . . . . 0.0 114.275 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -67.47 -51.97 44.91 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.818 0.447 . . . . 0.0 110.555 176.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 20' ' ' LEU . . . . . 0.497 HD13 HD23 ' A' ' 51' ' ' LEU . 2.7 tm? -63.44 -37.18 86.29 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.996 1.319 . . . . 0.0 110.652 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 21' ' ' GLU . . . . . 0.746 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 29.3 tt0 -56.56 -48.72 76.73 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.537 1.135 . . . . 0.0 110.305 171.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -62.84 -38.88 92.54 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.152 -177.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 23' ' ' ARG . . . . . 0.483 ' O ' HG21 ' A' ' 27' ' ' VAL . 26.8 mmt180 -64.96 -51.91 59.18 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 122.764 0.425 . . . . 0.0 111.477 178.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 24' ' ' ILE . . . . . 0.463 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 61.6 mt -57.35 -47.85 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 O-C-N 123.865 0.728 . . . . 0.0 110.514 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 25' ' ' LEU . . . . . 0.429 HD23 ' HB3' ' A' ' 63' ' ' LYS . 94.3 mt -65.55 -32.95 74.81 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.189 0.596 . . . . 0.0 111.422 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -69.94 -43.02 72.44 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.497 0.498 . . . . 0.0 110.102 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 27' ' ' VAL . . . . . 0.483 HG21 ' O ' ' A' ' 23' ' ' ARG . 87.8 t -56.57 -43.5 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.684 0.794 . . . . 0.0 110.748 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 28' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 79.9 mt -66.56 -42.82 86.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.293 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.5 m -72.85 -38.17 67.17 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.187 0.995 . . . . 0.0 111.91 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.51 -42.65 74.43 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.751 0.42 . . . . 0.0 110.644 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.99 -36.94 83.28 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.722 0.639 . . . . 0.0 110.862 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 59.11 34.12 77.93 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 124.155 0.909 . . . . 0.0 112.508 -174.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.9 t -164.29 151.56 10.25 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.459 1.104 . . . . 0.0 108.615 -166.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.59 118.87 5.56 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.366 2.711 . . . . 0.0 112.607 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 46.6 t -102.96 127.58 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -68.95 150.49 47.66 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.421 0.689 . . . . 0.0 110.709 -178.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 37' ' ' LEU . . . . . 0.507 HD21 ' HG3' ' A' ' 48' ' ' LYS . 57.6 tp -58.58 -46.78 86.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.076 0.95 . . . . 0.0 111.373 -179.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.86 -35.93 46.67 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.937 0.895 . . . . 0.0 113.269 171.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.33 -34.13 48.78 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.9 mt -64.18 -33.42 75.74 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.954 0.902 . . . . 0.0 110.728 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 41' ' ' VAL . . . . . 0.563 ' HA ' HD13 ' A' ' 51' ' ' LEU . 83.4 t -58.91 -47.74 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 123.318 0.647 . . . . 0.0 110.259 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -67.4 -54.04 23.94 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.28 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -70.29 -48.95 54.36 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.803 0.841 . . . . 0.0 112.867 -171.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 44.3 m -77.31 -16.06 59.12 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 62.74 56.28 1.96 Allowed 'General case' 0 C--N 1.364 1.215 0 C-N-CA 124.295 1.038 . . . . 0.0 110.574 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.43 151.32 36.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.105 -173.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -59.54 137.61 78.74 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.834 2.356 . . . . 0.0 111.969 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 48' ' ' LYS . . . . . 0.507 ' HG3' HD21 ' A' ' 37' ' ' LEU . 22.7 ttmm -35.1 -48.35 0.42 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.595 1.558 . . . . 0.0 112.945 169.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -61.33 -48.34 81.8 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 111.82 -178.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.9 -46.72 86.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.287 0.635 . . . . 0.0 110.164 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 51' ' ' LEU . . . . . 0.563 HD13 ' HA ' ' A' ' 41' ' ' VAL . 83.6 mt -52.79 -53.71 44.43 Favored 'General case' 0 C--O 1.206 -1.204 0 O-C-N 124.353 1.033 . . . . 0.0 110.735 174.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -59.21 -46.37 88.64 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.582 1.177 . . . . 0.0 112.766 -175.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.61 -43.21 72.0 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.428 0.455 . . . . 0.0 111.254 176.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 54' ' ' VAL . . . . . 0.459 HG21 HD12 ' A' ' 20' ' ' LEU . 50.7 t -72.79 -39.35 59.45 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.987 176.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.2 -53.88 53.24 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.781 1.232 . . . . 0.0 114.232 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -69.84 -26.31 64.16 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 119.557 1.071 . . . . 0.0 110.49 -176.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -65.03 -53.26 48.81 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.037 0.935 . . . . 0.0 109.387 171.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 58' ' ' MET . . . . . 0.746 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 73.3 mtm -64.04 -26.92 68.78 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.51 1.124 . . . . 0.0 111.906 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -66.86 -41.1 87.86 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.564 0.746 . . . . 0.0 110.347 176.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -63.45 -40.33 96.85 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.477 0.711 . . . . 0.0 109.939 172.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.77 0.65 22.9 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.852 0.861 . . . . 0.0 111.944 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.8 mt 67.96 10.45 7.81 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 125.881 1.672 . . . . 0.0 113.298 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 63' ' ' LYS . . . . . 0.554 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 55.0 mttm -69.24 -44.12 72.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.479 1.112 . . . . 0.0 110.533 177.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 26.8 m -123.32 164.41 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.657 0.783 . . . . 0.0 109.778 -178.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.2 t -147.03 157.64 43.68 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.723 0.809 . . . . 0.0 109.034 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 30.8 tp -101.5 106.89 18.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -178.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.2 p -86.08 -40.39 15.77 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.237 0.615 . . . . 0.0 110.748 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 68' ' ' SER . . . . . 0.415 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 16.0 p -142.21 160.65 54.15 Favored Pre-proline 0 CA--C 1.558 1.285 0 CA-C-O 117.753 -1.118 . . . . 0.0 108.357 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig core ' A' A ' 69' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 37.2 Cg_exo -22.97 -70.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.393 2.892 1 C-N-CA 126.099 4.533 . . . . 0.0 117.79 -168.426 . . . . . . . . 3 3 . 1 . 020 nuclear orig core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.34 42.08 2.49 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.637 0.775 . . . . 0.0 110.506 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.3 m -130.16 125.95 36.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.677 0.791 . . . . 0.0 109.92 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -115.5 136.06 53.46 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.652 0.781 . . . . 0.0 109.259 -174.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 32.3 t -118.31 171.52 8.08 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.0 tp -68.83 104.75 2.13 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 173.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 1.215 0 O-C-N 123.946 0.779 . . . . 0.0 111.379 -178.212 . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.3 mtm . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 001 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 75.68 -64.18 2.62 Favored Glycine 0 N--CA 1.482 1.715 0 C-N-CA 123.541 0.591 . . . . 0.0 113.52 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -55.41 -15.74 2.94 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 125.634 1.574 . . . . 0.0 114.338 178.943 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -69.53 -20.08 63.69 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.831 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -65.35 -19.39 65.93 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.621 0.368 . . . . 0.0 111.068 175.076 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -85.83 142.49 28.88 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.565 0.746 . . . . 0.0 109.898 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 70.0 m-70 -98.71 -157.71 0.62 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.864 0.866 . . . . 0.0 110.212 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -91.74 30.06 1.43 Allowed 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 124.892 1.277 . . . . 0.0 111.306 -177.316 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.522 ' HB2' ' NH1' ' A' ' 16' ' ' ARG . 10.2 m 60.13 82.59 0.15 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.414 1.086 . . . . 0.0 109.489 -173.548 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.6 t60 -70.4 -37.59 74.5 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.774 1.23 . . . . 0.0 111.284 -170.205 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.8 mmt -77.2 171.74 14.35 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.845 0.858 . . . . 0.0 110.611 -178.864 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.7 78.98 3.34 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.607 0.763 . . . . 0.0 109.721 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.423 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 31.8 t70 -66.18 119.76 64.45 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.546 -176.235 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . 0.423 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 3.5 Cg_exo -78.14 51.93 3.87 Favored 'Trans proline' 0 C--N 1.386 2.52 0 C-N-CA 124.045 3.163 . . . . 0.0 113.627 -176.364 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 148.43 72.83 0.01 OUTLIER Glycine 0 C--N 1.338 0.67 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 176.956 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.522 ' NH1' ' HB2' ' A' ' 9' ' ' SER . 9.4 tpp180 -56.95 -38.09 72.45 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.112 0.965 . . . . 0.0 112.079 -173.449 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -67.88 -35.13 77.97 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.252 0.621 . . . . 0.0 111.211 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -62.93 -44.44 97.4 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-O 119.446 -0.641 . . . . 0.0 112.855 171.295 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -66.87 -42.9 84.85 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.51 0.671 . . . . 0.0 109.745 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.424 HD11 HD23 ' A' ' 51' ' ' LEU . 2.0 tm? -62.42 -41.41 98.68 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.609 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.487 ' HG3' ' HE1' ' A' ' 58' ' ' MET . 34.7 tt0 -64.42 -42.82 95.84 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.673 0.789 . . . . 0.0 110.33 178.492 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 99.3 mt-30 -62.31 -36.25 81.57 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.06 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.502 ' O ' HG23 ' A' ' 27' ' ' VAL . 34.9 mmm-85 -64.84 -50.66 65.77 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 123.702 0.626 . . . . 0.0 110.852 175.418 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 80.2 mt -56.63 -50.39 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 124.141 0.9 . . . . 0.0 109.864 -176.269 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.533 HD23 ' HB3' ' A' ' 63' ' ' LYS . 96.1 mt -61.69 -37.84 85.62 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.594 0.758 . . . . 0.0 111.274 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -69.58 -44.47 70.75 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.016 0.926 . . . . 0.0 110.517 -176.981 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.502 HG23 ' O ' ' A' ' 23' ' ' ARG . 94.4 t -60.1 -43.12 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.95 0.9 . . . . 0.0 110.241 176.467 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.453 HD22 ' HA ' ' A' ' 73' ' ' CYS . 80.6 mt -64.48 -34.96 79.42 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.853 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.6 m -74.52 -43.15 57.25 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 123.644 0.778 . . . . 0.0 111.283 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -62.67 -41.57 99.15 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.451 0.7 . . . . 0.0 110.361 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -41.91 92.6 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.976 0.798 . . . . 0.0 110.417 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 63.62 27.61 71.24 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.464 -170.062 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.9 m -159.16 161.74 27.28 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.016 1.326 . . . . 0.0 109.611 -166.873 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -53.84 125.85 20.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 122.802 2.335 . . . . 0.0 113.473 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.444 HG23 HG12 ' A' ' 27' ' ' VAL . 76.8 t -107.37 130.45 59.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.18 0.992 . . . . 0.0 108.392 174.54 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.32 151.59 47.2 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.639 0.776 . . . . 0.0 110.499 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 54.5 tp -63.04 -49.01 76.24 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.969 0.907 . . . . 0.0 110.425 179.723 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -50.09 -37.6 34.59 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.822 0.849 . . . . 0.0 112.333 170.941 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.423 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 46.3 tt0 -73.95 -36.38 64.62 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.88 -31.51 72.56 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.272 0.629 . . . . 0.0 110.393 178.488 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.512 ' HA ' HD11 ' A' ' 51' ' ' LEU . 45.4 t -57.85 -54.03 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 O-C-N 123.573 0.546 . . . . 0.0 110.717 174.903 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.423 ' HE3' ' HG3' ' A' ' 39' ' ' GLN . 20.6 pttp -75.13 -39.21 60.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.499 -173.796 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -65.39 -58.21 6.44 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.42 0.688 . . . . 0.0 111.87 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 37.6 m -80.97 -4.36 54.79 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.817 0.447 . . . . 0.0 111.252 -173.717 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 62.08 31.25 17.91 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.12 1.368 . . . . 0.0 111.597 171.219 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -128.47 150.06 73.41 Favored Pre-proline 0 N--CA 1.476 0.873 0 C-N-CA 123.52 0.728 . . . . 0.0 110.344 -175.858 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.2 142.07 71.99 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.458 2.106 . . . . 0.0 111.757 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -43.46 -41.3 4.24 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.769 1.228 . . . . 0.0 112.051 172.893 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -54.09 -51.69 63.36 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.362 1.065 . . . . 0.0 111.625 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -66.49 -44.9 81.36 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.568 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.512 HD11 ' HA ' ' A' ' 41' ' ' VAL . 98.5 mt -54.75 -51.17 66.52 Favored 'General case' 0 C--O 1.212 -0.879 0 O-C-N 124.43 1.081 . . . . 0.0 111.253 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.8 m120 -48.74 -56.75 7.73 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.087 0.955 . . . . 0.0 112.194 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -58.93 -41.89 88.46 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 123.997 0.81 . . . . 0.0 112.115 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.48 HG12 HH21 ' A' ' 57' ' ' ARG . 86.1 t -68.95 -48.31 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 122.987 0.515 . . . . 0.0 110.259 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -55.59 -38.29 69.2 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.563 1.545 . . . . 0.0 114.178 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -70.41 -30.78 67.75 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 118.767 0.712 . . . . 0.0 110.792 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.48 HH21 HG12 ' A' ' 54' ' ' VAL . 46.5 ttp180 -71.42 -44.23 65.26 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.858 0.724 . . . . 0.0 109.348 176.389 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.487 ' HE1' ' HG3' ' A' ' 21' ' ' GLU . 80.5 mtp -63.55 -31.98 73.3 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.335 1.054 . . . . 0.0 111.046 176.0 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.52 -44.92 95.17 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.708 0.803 . . . . 0.0 110.611 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.43 ' HD2' ' HA ' ' A' ' 57' ' ' ARG . 52.7 mttm -63.02 -35.9 81.77 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.623 0.769 . . . . 0.0 110.749 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -85.88 5.25 33.74 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.555 0.742 . . . . 0.0 111.312 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.8 mt 66.36 9.95 6.84 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 125.218 1.407 . . . . 0.0 113.016 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.533 ' HB3' HD23 ' A' ' 25' ' ' LEU . 94.2 mttt -69.11 -35.34 76.32 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.372 1.069 . . . . 0.0 111.094 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.475 HG11 ' HE2' ' A' ' 58' ' ' MET . 30.5 m -129.8 158.67 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.613 0.765 . . . . 0.0 109.919 177.586 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.1 m -132.92 152.85 51.83 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.421 1.089 . . . . 0.0 108.075 172.78 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.96 112.77 24.58 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.1 p -87.58 -37.72 16.59 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.12 0.568 . . . . 0.0 111.553 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.639 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 9.2 t -140.59 155.09 69.75 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -176.663 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -26.18 -68.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.391 2.799 0 C-N-CA 125.071 3.847 . . . . 0.0 116.495 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.22 41.35 2.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.186 0.594 . . . . 0.0 110.902 176.138 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.639 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 26.5 m -129.37 125.71 37.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.641 0.776 . . . . 0.0 108.955 174.752 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -108.27 163.83 12.85 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.802 0.841 . . . . 0.0 109.219 -175.691 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.453 ' HA ' HD22 ' A' ' 28' ' ' LEU . 43.9 t -146.3 164.02 33.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 177.195 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.441 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 35.2 tp -68.35 135.38 51.75 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.415 -0.958 . . . . 0.0 108.415 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.89 75.59 0.31 Allowed Glycine 0 C--N 1.351 1.393 0 O-C-N 124.174 0.922 . . . . 0.0 111.608 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 74.28 -82.45 0.78 Allowed Glycine 0 C--N 1.346 1.096 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -171.164 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.9 t -162.11 -160.48 0.68 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.851 1.26 . . . . 0.0 108.01 176.751 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -61.6 126.02 85.85 Favored Pre-proline 0 N--CA 1.474 0.747 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 167.295 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -64.65 98.66 0.3 Allowed 'Trans proline' 0 C--N 1.374 1.878 0 C-N-CA 122.355 2.037 . . . . 0.0 111.196 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 . . . . . 0 CA--C 1.553 1.071 0 C-N-CA 123.474 0.71 . . . . 0.0 109.458 -179.351 . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.8 tpt . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 0 0 . 1 . 002 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.22 45.71 94.94 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.681 -0.691 . . . . 0.0 113.477 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 69.29 162.29 0.22 Allowed 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 124.869 1.268 . . . . 0.0 111.331 -176.255 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -52.45 121.67 7.44 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.234 0.614 . . . . 0.0 109.362 170.039 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -46.17 -51.46 14.08 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.72 1.208 . . . . 0.0 112.135 -170.744 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -162.04 104.62 1.16 Allowed 'General case' 0 C--O 1.236 0.387 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 173.411 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -61.03 92.32 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.726 0.81 . . . . 0.0 109.983 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 56.13 -80.38 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.268 1.427 . . . . 0.0 112.137 179.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.9 p -153.18 2.0 0.28 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.324 0.649 . . . . 0.0 111.593 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 67.45 6.3 4.83 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 125.136 1.375 . . . . 0.0 110.607 -169.219 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 56.9 mtt -145.49 -171.93 3.78 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 125.805 1.642 . . . . 0.0 107.743 -172.13 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.83 -174.38 3.49 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 165.272 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . 0.585 ' HB2' ' HG2' ' A' ' 16' ' ' ARG . 6.3 m-20 -70.92 134.44 85.71 Favored Pre-proline 0 N--CA 1.484 1.251 0 O-C-N 122.093 -0.379 . . . . 0.0 110.504 177.954 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -62.39 121.19 9.07 Favored 'Trans proline' 0 C--N 1.375 1.956 0 C-N-CA 122.793 2.329 . . . . 0.0 110.988 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 45.82 58.97 5.19 Favored Glycine 0 C--N 1.355 1.601 0 O-C-N 124.338 1.024 . . . . 0.0 114.073 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.585 ' HG2' ' HB2' ' A' ' 13' ' ' ASP . 36.0 mtp-105 -47.73 -60.92 2.22 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.621 1.169 . . . . 0.0 112.848 -172.344 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -65.53 -35.58 81.28 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 123.942 0.776 . . . . 0.0 111.524 -173.639 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.42 -52.76 47.97 Favored Glycine 0 C--N 1.346 1.134 0 N-CA-C 114.371 0.508 . . . . 0.0 114.371 171.68 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -67.27 -36.04 80.76 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.961 0.504 . . . . 0.0 110.155 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.419 ' O ' HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -64.37 -51.88 61.08 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.123 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.29 -47.43 79.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.96 0.904 . . . . 0.0 111.108 -175.444 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -38.11 85.7 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 124.067 0.854 . . . . 0.0 110.739 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.403 ' O ' HG23 ' A' ' 27' ' ' VAL . 14.1 tpp180 -71.83 -38.51 70.15 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 122.986 0.514 . . . . 0.0 110.857 -178.094 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.419 HG13 ' O ' ' A' ' 20' ' ' LEU . 82.5 mt -58.76 -51.76 68.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 122.806 0.443 . . . . 0.0 109.934 174.592 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 98.6 mt -56.1 -43.15 77.82 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 123.672 0.789 . . . . 0.0 110.905 178.192 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -61.64 -51.18 69.51 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 124.194 0.934 . . . . 0.0 111.12 -175.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.403 HG23 ' O ' ' A' ' 23' ' ' ARG . 87.7 t -57.82 -41.97 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 124.133 0.896 . . . . 0.0 110.971 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.05 -33.11 71.53 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.252 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.6 m -71.64 -49.43 40.08 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 123.432 0.693 . . . . 0.0 112.12 177.928 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.51 -36.46 82.64 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.21 0.604 . . . . 0.0 110.268 -176.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.62 -38.35 70.81 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.815 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.52 22.98 64.33 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 124.031 0.832 . . . . 0.0 113.342 -176.859 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.6 m -152.62 164.88 18.89 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.149 0.98 . . . . 0.0 109.724 -167.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -58.93 117.09 3.76 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 122.364 2.043 . . . . 0.0 112.509 172.397 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.4 t -111.31 133.2 57.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.625 1.17 . . . . 0.0 108.573 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.426 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 59.4 mtpt -68.77 144.58 54.29 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.347 0.659 . . . . 0.0 109.875 177.886 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.473 HD13 HD11 ' A' ' 55' ' ' LEU . 29.1 tp -58.48 -40.44 82.74 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.721 0.638 . . . . 0.0 110.808 176.204 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.02 -44.83 2.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.418 1.087 . . . . 0.0 113.16 167.133 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -81.66 -32.61 31.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.346 0.258 . . . . 0.0 110.536 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.3 mt -58.62 -33.52 70.13 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.666 0.387 . . . . 0.0 110.194 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.414 HG23 ' O ' ' A' ' 37' ' ' LEU . 99.0 t -52.8 -58.8 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.78 0.832 . . . . 0.0 112.285 173.49 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -70.5 -40.96 73.27 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -69.33 -43.58 73.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 82.0 m -77.77 -15.47 59.08 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 61.28 26.15 16.03 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.786 0.835 . . . . 0.0 110.296 -173.698 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.91 143.75 31.4 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 124.124 0.969 . . . . 0.0 110.081 -171.652 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.66 138.32 41.23 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.583 2.189 . . . . 0.0 111.615 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -47.99 -30.3 4.19 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.218 1.407 . . . . 0.0 112.721 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 mtm180 -56.45 -56.69 18.01 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.143 0.977 . . . . 0.0 111.136 174.871 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -66.23 -43.01 87.82 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.21 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.7 mt -54.74 -52.9 61.07 Favored 'General case' 0 C--O 1.209 -1.048 0 O-C-N 124.448 1.093 . . . . 0.0 110.098 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -47.53 -58.9 3.67 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.283 1.033 . . . . 0.0 112.08 176.363 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 46.8 mt-30 -53.51 -50.88 64.48 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.226 1.01 . . . . 0.0 112.339 -177.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.29 -43.68 84.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 C-N-CA 123.147 0.579 . . . . 0.0 111.462 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.473 HD11 HD13 ' A' ' 37' ' ' LEU . 27.8 mt -48.19 -48.5 34.66 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.992 1.317 . . . . 0.0 114.265 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -72.48 -25.62 61.49 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.392 0.996 . . . . 0.0 111.86 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -70.31 -55.34 9.42 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.451 ' HB2' ' HB2' ' A' ' 63' ' ' LYS . 18.0 ptm -67.99 -23.85 65.07 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.922 -178.29 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.2 tttm -69.15 -43.1 74.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.608 0.763 . . . . 0.0 110.72 171.663 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.517 ' HB2' ' HZ3' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -59.19 -37.88 78.48 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.98 0.912 . . . . 0.0 110.577 175.298 . . . . . . . . 3 3 . 1 . 002 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -86.21 -0.49 55.87 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 115.056 -0.975 . . . . 0.0 112.038 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.3 mt 60.8 24.72 14.62 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.068 1.347 . . . . 0.0 112.688 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.451 ' HB2' ' HB2' ' A' ' 58' ' ' MET . 55.1 mttm -67.5 -32.13 72.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.505 1.122 . . . . 0.0 109.569 168.25 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.447 HG22 ' HG3' ' A' ' 58' ' ' MET . 28.1 m -133.37 160.79 42.17 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.558 171.719 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.1 m -129.85 156.46 44.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 171.541 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.4 tp -103.07 112.4 25.22 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.9 p -94.9 -43.82 8.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.696 0.399 . . . . 0.0 111.23 -174.597 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.687 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 19.6 m -132.93 162.34 58.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.478 0.711 . . . . 0.0 110.183 -175.274 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.6 115.86 2.75 Favored 'Trans proline' 0 C--N 1.379 2.175 0 C-N-CA 122.972 2.448 . . . . 0.0 112.247 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 70.54 9.89 7.02 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.42 1.488 . . . . 0.0 112.386 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.687 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 28.0 m -124.58 121.77 35.7 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.258 0.623 . . . . 0.0 109.418 -174.501 . . . . . . . . 2 2 . 1 . 002 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -107.67 165.83 11.14 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.272 1.029 . . . . 0.0 109.591 -172.306 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 52.2 t -146.15 158.58 43.88 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 43.5 tp -69.46 138.35 53.38 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.477 0.486 . . . . 0.0 110.186 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -79.32 71.13 2.7 Favored Glycine 0 C--N 1.343 0.969 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 176.116 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.85 -79.43 0.48 Allowed Glycine 0 C--N 1.35 1.347 0 N-CA-C 111.779 -0.528 . . . . 0.0 111.779 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.4 t -154.76 13.07 0.4 Allowed 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.515 1.126 . . . . 0.0 110.525 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.4 t70 62.49 85.12 0.18 Allowed Pre-proline 0 N--CA 1.483 1.223 0 C-N-CA 124.184 0.994 . . . . 0.0 109.218 -165.296 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.73 -25.18 12.7 Favored 'Trans proline' 0 C--N 1.376 1.979 0 C-N-CA 122.491 2.127 . . . . 0.0 113.259 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 119.112 -0.471 . . . . 0.0 109.981 -173.175 . . . . . . . . 0 0 . 1 . 003 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.501 ' HE2' ' HD2' ' A' ' 57' ' ' ARG . 1.5 mpt? . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 . . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -59.32 112.37 4.19 Favored Glycine 0 C--N 1.355 1.627 0 O-C-N 124.322 1.014 . . . . 0.0 112.832 -178.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 -145.76 8.71 1.14 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 122.912 0.485 . . . . 0.0 112.226 -177.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -66.49 106.18 1.69 Allowed 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.053 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.532 ' HA ' ' OG ' ' A' ' 9' ' ' SER . 95.8 m-70 -72.86 72.08 1.07 Allowed 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.014 0.925 . . . . 0.0 112.027 -172.562 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -153.4 50.97 0.71 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 125.727 1.611 . . . . 0.0 107.273 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 82.3 t60 68.39 6.58 5.44 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 124.715 1.206 . . . . 0.0 111.345 -174.318 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -125.47 31.71 5.49 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.859 0.864 . . . . 0.0 109.915 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 9' ' ' SER . . . . . 0.532 ' OG ' ' HA ' ' A' ' 5' ' ' HIS . 17.7 m -79.2 22.26 0.42 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.446 0.698 . . . . 0.0 111.885 177.107 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -150.41 157.44 43.04 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 125.186 1.394 . . . . 0.0 107.752 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.473 ' HE2' ' HG3' ' A' ' 17' ' ' GLU . 14.1 tpt -91.07 90.33 7.79 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.474 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.53 94.57 0.19 Allowed 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.64 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 65.87 116.07 0.03 OUTLIER Pre-proline 0 CA--C 1.556 1.174 0 O-C-N 124.887 1.367 . . . . 0.0 109.971 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -72.5 32.91 0.29 Allowed 'Trans proline' 0 N--CA 1.5 1.906 0 C-N-CA 123.459 2.772 . . . . 0.0 114.481 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -50.29 -59.76 7.37 Favored Glycine 0 C--N 1.355 1.586 0 N-CA-C 115.134 0.814 . . . . 0.0 115.134 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -64.46 -43.42 94.28 Favored 'General case' 0 C--N 1.358 0.951 0 CA-C-N 117.573 0.686 . . . . 0.0 112.408 -176.425 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.473 ' HG3' ' HE2' ' A' ' 11' ' ' MET . 60.9 mt-10 -66.25 -41.21 90.3 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 122.838 0.455 . . . . 0.0 111.93 178.011 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.05 -29.13 72.39 Favored Glycine 0 C--N 1.343 0.929 0 O-C-N 123.996 0.81 . . . . 0.0 112.592 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -84.01 -31.89 25.21 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.445 HD11 HG21 ' A' ' 54' ' ' VAL . 2.4 tm? -65.16 -42.29 93.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.322 1.049 . . . . 0.0 109.059 172.005 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -62.88 -43.57 98.44 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.1 1.36 . . . . 0.0 109.444 173.601 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.1 tm0? -60.81 -44.12 97.29 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.006 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 27.7 tpt180 -68.47 -43.29 77.28 Favored 'General case' 0 C--N 1.347 0.483 0 O-C-N 123.685 0.616 . . . . 0.0 111.141 -177.109 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.423 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 84.7 mt -57.07 -50.33 76.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.88 -32.5 74.04 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.503 0.721 . . . . 0.0 111.29 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.45 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 20.2 tp60 -68.93 -45.27 71.22 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 123.003 0.521 . . . . 0.0 110.1 -179.708 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 80.5 t -62.06 -36.79 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.386 0.674 . . . . 0.0 110.303 177.471 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.423 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 96.2 mt -66.14 -39.91 90.2 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.552 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 62.6 m -72.03 -48.6 43.36 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.328 1.051 . . . . 0.0 111.984 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.45 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.8 mm-40 -68.65 -34.85 76.43 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 118.085 0.402 . . . . 0.0 111.141 -175.251 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.07 -39.36 90.02 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.351 170.628 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.12 23.03 59.09 Favored Glycine 0 C--N 1.356 1.659 0 O-C-N 123.86 0.725 . . . . 0.0 112.321 -174.401 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -153.43 150.15 22.91 Favored Pre-proline 0 C--O 1.24 0.569 0 C-N-CA 124.574 1.15 . . . . 0.0 108.346 -169.398 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.619 ' HB3' ' SG ' ' A' ' 73' ' ' CYS . 6.1 Cg_endo -48.53 112.77 0.67 Allowed 'Trans proline' 0 C--N 1.375 1.969 0 C-N-CA 123.804 3.002 . . . . 0.0 113.026 175.918 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 85.4 t -96.82 136.72 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -77.53 155.93 31.29 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.453 ' O ' HG21 ' A' ' 41' ' ' VAL . 23.0 tp -64.27 -46.23 84.58 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.045 0.938 . . . . 0.0 109.122 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.31 -44.37 33.87 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 0.0 112.48 168.389 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.69 -32.34 65.71 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 117.953 0.342 . . . . 0.0 110.363 179.001 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.6 mt -62.15 -35.63 79.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.849 0.459 . . . . 0.0 110.198 176.76 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.453 HG21 ' O ' ' A' ' 37' ' ' LEU . 61.2 t -56.06 -54.7 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.353 0.661 . . . . 0.0 111.563 177.261 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -71.98 -45.81 59.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.527 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.44 -39.62 94.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 68.5 m -82.24 -18.54 42.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 119.242 -0.408 . . . . 0.0 111.426 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 59.11 31.55 21.39 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.831 0.852 . . . . 0.0 109.905 -173.048 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.28 146.79 45.5 Favored Pre-proline 0 C--O 1.241 0.642 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.239 -169.038 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -63.76 129.41 24.74 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 122.802 2.335 . . . . 0.0 112.391 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.462 ' HZ2' ' HB3' ' A' ' 48' ' ' LYS . 5.1 ttpm? -51.78 -28.67 16.16 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 124.341 1.026 . . . . 0.0 112.925 177.588 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.3 mtm180 -53.96 -57.03 12.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.525 0.73 . . . . 0.0 110.392 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.1 mp0 -66.75 -44.45 81.47 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.768 -175.705 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.429 HD23 HD12 ' A' ' 20' ' ' LEU . 92.2 mt -55.71 -56.38 21.08 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 124.208 0.942 . . . . 0.0 110.401 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -48.7 -53.11 20.11 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.798 1.239 . . . . 0.0 111.374 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -52.15 -56.89 11.67 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 124.1 0.96 . . . . 0.0 112.619 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.648 HG12 ' SD ' ' A' ' 58' ' ' MET . 60.7 t -66.68 -35.56 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.001 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.401 HD12 ' NE1' ' A' ' 72' ' ' TRP . 36.3 mt -52.15 -48.79 64.72 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.479 1.111 . . . . 0.0 113.262 -179.881 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -73.88 -25.18 59.9 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 118.253 0.479 . . . . 0.0 110.782 -175.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.501 ' HD2' ' HE2' ' A' ' 1' ' ' MET . 79.0 ttt180 -67.59 -52.28 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.587 0.755 . . . . 0.0 109.418 172.309 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.648 ' SD ' HG12 ' A' ' 54' ' ' VAL . 70.7 mtp -59.74 -26.58 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.489 1.116 . . . . 0.0 111.368 176.007 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -70.99 -37.2 72.71 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.777 0.431 . . . . 0.0 110.167 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.31 -30.67 68.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.088 0.555 . . . . 0.0 110.412 173.247 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -77.62 -5.66 51.09 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.267 0.627 . . . . 0.0 111.271 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 55.4 mt 68.13 17.58 9.41 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.884 1.274 . . . . 0.0 111.037 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -81.75 -28.67 33.21 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.889 1.276 . . . . 0.0 111.803 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.434 HG11 ' HE1' ' A' ' 58' ' ' MET . 32.9 m -130.86 158.8 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.225 0.61 . . . . 0.0 109.665 174.825 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.5 m -143.65 149.45 37.28 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -101.28 108.54 20.21 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.429 HG23 ' SG ' ' A' ' 73' ' ' CYS . 33.7 p -99.04 -32.21 11.39 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.25 0.548 . . . . 0.0 111.093 -176.375 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.575 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 35.8 t -140.22 153.83 69.36 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -43.67 114.18 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.519 0 C-N-CA 123.549 2.833 . . . . 0.0 114.011 175.155 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 59.8 26.89 16.11 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.753 1.221 . . . . 0.0 112.117 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.575 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 41.9 m -130.88 125.33 33.28 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 123.259 0.624 . . . . 0.0 109.516 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.401 ' NE1' HD12 ' A' ' 55' ' ' LEU . 67.0 m95 -117.44 146.53 43.41 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.023 0.929 . . . . 0.0 109.205 -170.795 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.619 ' SG ' ' HB3' ' A' ' 34' ' ' PRO . 78.4 m -113.68 158.66 20.59 Favored 'General case' 0 C--O 1.25 1.115 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.431 . . . . . . . . 2 2 . 1 . 003 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 33.1 tp -64.97 102.31 0.6 Allowed 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.988 174.04 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -82.94 -31.75 28.29 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.945 178.331 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -98.99 170.2 23.58 Favored Glycine 0 C--N 1.346 1.123 0 C-N-CA 122.969 0.319 . . . . 0.0 112.481 -174.552 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 26.6 m -91.66 72.03 5.84 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-O 121.942 0.877 . . . . 0.0 109.837 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.33 -51.69 9.71 Favored Pre-proline 0 CA--C 1.559 1.324 0 CA-C-N 114.588 -1.187 . . . . 0.0 113.013 177.774 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -65.43 -21.7 60.27 Favored 'Trans proline' 0 C--N 1.38 2.216 0 C-N-CA 122.24 1.96 . . . . 0.0 113.72 -172.945 . . . . . . . . 1 1 . 1 . 003 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -175.999 . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 004 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.24 90.25 0.22 Allowed Glycine 0 C--N 1.351 1.366 0 CA-C-O 119.987 -0.34 . . . . 0.0 112.971 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 70.04 147.26 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 125.867 1.667 . . . . 0.0 112.193 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.6 p-80 -141.01 151.06 43.82 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.55 1.14 . . . . 0.0 108.882 174.011 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -158.62 102.98 1.72 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.124 0.569 . . . . 0.0 110.66 176.527 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -135.69 -10.9 2.09 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.71 0.804 . . . . 0.0 110.727 171.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -143.66 -152.53 0.42 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.723 0.809 . . . . 0.0 109.359 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 68.32 -87.31 0.03 OUTLIER 'General case' 0 C--N 1.364 1.207 0 C-N-CA 124.993 1.317 . . . . 0.0 111.13 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.8 m -78.08 -16.12 58.3 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.961 0.505 . . . . 0.0 111.465 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -143.72 87.25 1.91 Allowed 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.0 ptt? -147.28 105.53 3.77 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.417 1.087 . . . . 0.0 108.153 178.542 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.06 175.5 0.2 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.402 1.081 . . . . 0.0 111.593 -172.053 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 70.54 132.39 0.04 OUTLIER Pre-proline 0 N--CA 1.489 1.507 0 C-N-CA 125.307 1.443 . . . . 0.0 112.024 173.739 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_exo -54.59 -43.79 55.66 Favored 'Trans proline' 0 C--N 1.377 2.043 0 C-N-CA 122.492 2.128 . . . . 0.0 110.922 167.727 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 40.58 48.43 3.91 Favored Glycine 0 C--N 1.36 1.866 0 O-C-N 125.324 1.64 . . . . 0.0 114.35 171.322 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.43 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 79.4 mtp180 -57.7 -47.81 81.31 Favored 'General case' 0 C--O 1.215 -0.756 0 C-N-CA 123.976 0.911 . . . . 0.0 112.472 -163.8 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -69.17 -48.54 61.95 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.272 0.629 . . . . 0.0 111.618 -174.873 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.18 -39.34 94.38 Favored Glycine 0 C--N 1.344 1.024 0 O-C-N 123.351 0.407 . . . . 0.0 113.683 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -77.77 -30.95 51.7 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.702 0.401 . . . . 0.0 110.209 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.558 HD21 ' SG ' ' A' ' 44' ' ' CYS . 3.0 tm? -60.92 -46.99 88.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.839 1.256 . . . . 0.0 109.529 173.419 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.677 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 21.0 tt0 -58.19 -51.6 69.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.799 1.24 . . . . 0.0 110.352 177.835 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -63.95 -34.66 78.48 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.68 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -68.66 -46.15 69.88 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.078 0.551 . . . . 0.0 112.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.5 mt -59.33 -50.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 122.753 0.421 . . . . 0.0 110.111 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.9 mt -64.87 -31.89 73.33 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.317 0.647 . . . . 0.0 110.636 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.47 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 22.1 tt0 -68.68 -47.95 65.17 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.103 0.561 . . . . 0.0 110.14 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.58 -36.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.246 1.018 . . . . 0.0 110.848 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.57 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 89.1 mt -67.48 -40.29 85.28 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.644 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 53.1 m -66.12 -48.04 72.15 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.015 0.926 . . . . 0.0 111.428 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.47 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 21.9 mm-40 -67.91 -38.94 83.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.457 0.703 . . . . 0.0 111.575 -174.471 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.52 96.14 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.877 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.96 28.57 72.21 Favored Glycine 0 C--N 1.351 1.389 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.057 -172.69 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.2 m -153.8 158.55 32.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 124.428 1.091 . . . . 0.0 109.029 -169.223 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -60.49 122.03 10.66 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.219 1.946 . . . . 0.0 112.106 169.982 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.3 t -107.74 130.68 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.432 1.093 . . . . 0.0 108.756 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.598 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.6 mttt -66.81 152.53 45.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 122.966 0.506 . . . . 0.0 110.837 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.485 ' O ' HG23 ' A' ' 41' ' ' VAL . 27.6 tp -59.72 -45.27 92.67 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 123.949 0.781 . . . . 0.0 109.817 174.221 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.33 -42.69 2.28 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.909 1.283 . . . . 0.0 113.818 168.303 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -84.68 -29.79 25.34 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.64 -33.03 74.2 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.728 0.411 . . . . 0.0 110.201 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.507 ' HA ' HD12 ' A' ' 51' ' ' LEU . 42.8 t -59.46 -55.15 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.56 0.744 . . . . 0.0 111.716 175.442 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -71.93 -39.58 69.35 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.456 -174.777 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -67.32 -50.53 59.71 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.947 0.499 . . . . 0.0 111.92 177.302 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.558 ' SG ' HD21 ' A' ' 20' ' ' LEU . 10.0 t -79.11 -12.85 60.01 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.842 0.457 . . . . 0.0 110.911 -175.584 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 61.78 28.97 17.84 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.818 1.247 . . . . 0.0 111.868 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -122.14 155.59 61.16 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 123.953 0.901 . . . . 0.0 111.367 -172.651 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.64 129.44 23.63 Favored 'Trans proline' 0 C--N 1.381 2.28 0 C-N-CA 122.169 1.912 . . . . 0.0 111.548 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HA ' HD11 ' A' ' 51' ' ' LEU . 40.9 ttmt -45.26 -41.01 8.09 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 124.722 1.209 . . . . 0.0 113.027 175.961 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -54.14 -46.92 72.35 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.269 1.027 . . . . 0.0 112.031 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -66.5 -43.49 85.16 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.652 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.523 HD11 ' HA ' ' A' ' 48' ' ' LYS . 85.2 mt -56.83 -52.02 66.71 Favored 'General case' 0 C--N 1.358 0.974 0 O-C-N 124.227 0.954 . . . . 0.0 111.252 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -48.47 -55.89 9.73 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.625 1.17 . . . . 0.0 111.966 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -60.56 -41.6 94.89 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.79 -174.89 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.4 t -69.56 -44.11 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 122.497 0.319 . . . . 0.0 110.299 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.407 HD13 ' NE1' ' A' ' 72' ' ' TRP . 35.4 mt -50.68 -49.49 57.21 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.917 1.287 . . . . 0.0 113.254 178.857 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.423 ' O ' ' HG2' ' A' ' 60' ' ' LYS . 69.1 m-85 -70.4 -27.55 64.38 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 119.038 0.835 . . . . 0.0 111.33 -177.001 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -72.26 -44.74 62.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.333 0.653 . . . . 0.0 109.496 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.677 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 71.5 mtm -64.49 -31.12 72.19 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.54 0.736 . . . . 0.0 111.217 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -66.61 -35.19 79.6 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.17 0.988 . . . . 0.0 110.974 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.423 ' HG2' ' O ' ' A' ' 56' ' ' TYR . 74.3 mmtt -57.51 -36.8 72.02 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.493 0.717 . . . . 0.0 111.14 170.932 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -90.55 5.1 49.2 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.321 1.048 . . . . 0.0 111.174 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 61.26 20.37 10.97 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.484 1.514 . . . . 0.0 112.798 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.555 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 95.2 mttt -70.68 -38.96 73.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.703 0.801 . . . . 0.0 110.637 176.422 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.5 m -125.04 154.21 32.89 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 C-N-CA 123.778 0.831 . . . . 0.0 109.356 175.163 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -138.88 143.88 38.94 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.405 1.082 . . . . 0.0 108.594 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.22 105.14 17.25 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -173.548 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.8 p -87.25 -36.92 17.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.706 0.802 . . . . 0.0 111.578 -173.635 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.558 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 27.7 m -137.14 163.79 46.68 Favored Pre-proline 0 CA--C 1.551 0.986 0 CA-C-O 117.526 -1.226 . . . . 0.0 107.709 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.403 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 25.6 Cg_exo -20.37 -63.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.399 3.205 1 C-N-CA 125.967 4.445 . . . . 0.0 116.785 -176.265 . . . . . . . . 3 3 . 1 . 004 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.77 10.39 8.97 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.228 0.611 . . . . 0.0 112.061 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.598 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 26.5 m -85.41 126.95 34.19 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.87 0.366 . . . . 0.0 110.562 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.407 ' NE1' HD13 ' A' ' 55' ' ' LEU . 90.7 m95 -108.15 166.17 10.94 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.549 1.14 . . . . 0.0 109.402 -177.865 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 47.4 t -150.17 157.22 42.87 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.57 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 29.3 tp -79.31 112.76 16.86 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.32 -38.39 91.42 Favored Glycine 0 CA--C 1.528 0.871 0 O-C-N 123.816 0.698 . . . . 0.0 112.336 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -153.69 134.41 4.36 Favored Glycine 0 C--N 1.349 1.251 0 CA-C-O 119.536 -0.591 . . . . 0.0 111.959 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.531 ' HA ' HD23 ' A' ' 74' ' ' LEU . 27.8 m -71.94 122.28 20.54 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.044 0.537 . . . . 0.0 109.853 178.018 . . . . . . . . 2 2 . 1 . 004 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -82.5 112.44 36.77 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 176.067 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -88.4 -158.68 0.08 OUTLIER 'Trans proline' 0 C--N 1.373 1.859 0 C-N-CA 122.617 2.211 . . . . 0.0 110.765 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 . . . . . 0 C--O 1.251 1.171 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 173.874 . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.2 mtt . . . . . 0 N--CA 1.479 0.981 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 005 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.52 -22.1 61.08 Favored Glycine 0 C--N 1.355 1.59 0 O-C-N 123.633 0.583 . . . . 0.0 113.867 -177.293 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -77.05 13.68 1.04 Allowed 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 124.217 1.007 . . . . 0.0 111.692 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -53.61 -52.24 60.47 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 122.987 0.515 . . . . 0.0 110.801 172.872 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 76.1 t60 58.25 -1.93 0.09 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.246 1.418 . . . . 0.0 114.706 171.645 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -70.58 -23.61 62.62 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.718 0.807 . . . . 0.0 111.794 -168.864 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -70.6 103.75 2.61 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.115 0.566 . . . . 0.0 109.492 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -164.97 41.56 0.08 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.121 0.969 . . . . 0.0 110.001 176.315 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.8 m -70.03 -15.12 62.97 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.401 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -78.58 -3.78 45.53 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.344 0.658 . . . . 0.0 111.251 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.6 mtt -79.32 -1.8 38.51 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 122.084 -0.385 . . . . 0.0 111.558 172.109 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -162.25 89.19 0.69 Allowed 'General case' 0 C--N 1.35 0.602 0 C-N-CA 124.313 1.045 . . . . 0.0 109.925 174.41 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -157.41 81.61 3.17 Favored Pre-proline 0 CA--C 1.553 1.087 0 C-N-CA 123.258 0.623 . . . . 0.0 111.304 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -88.45 27.25 0.54 Allowed 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 123.025 2.483 . . . . 0.0 112.968 179.089 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 55.73 -171.35 1.8 Allowed Glycine 0 N--CA 1.477 1.381 0 CA-C-N 115.597 -0.729 . . . . 0.0 113.735 -172.665 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 57.0 ttp180 -65.72 -10.07 33.46 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.872 0.869 . . . . 0.0 113.049 165.081 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -51.1 -51.18 55.88 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -162.882 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.35 -27.88 73.35 Favored Glycine 0 N--CA 1.472 1.056 0 O-C-N 123.419 0.449 . . . . 0.0 114.008 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -75.74 -38.0 58.85 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.617 0.767 . . . . 0.0 110.288 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.475 HD13 HG21 ' A' ' 54' ' ' VAL . 2.6 tm? -64.3 -41.63 96.77 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.058 0.943 . . . . 0.0 109.976 175.154 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.432 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 43.0 tt0 -63.52 -40.61 97.49 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.123 0.969 . . . . 0.0 110.422 173.785 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.52 -36.97 84.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.9 177.544 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.41 ' O ' HG23 ' A' ' 27' ' ' VAL . 1.3 mmp_? -62.07 -50.4 72.11 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.193 0.597 . . . . 0.0 110.961 172.937 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.416 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.2 mt -56.64 -47.97 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.024 0.828 . . . . 0.0 110.442 -176.561 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.576 HD21 ' HB3' ' A' ' 63' ' ' LYS . 78.1 mt -60.54 -46.81 88.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.515 0.726 . . . . 0.0 111.57 178.997 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -66.21 -43.18 87.45 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 123.668 0.605 . . . . 0.0 111.116 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.41 HG23 ' O ' ' A' ' 23' ' ' ARG . 70.9 t -61.02 -46.27 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.443 0.697 . . . . 0.0 110.163 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.454 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.8 mt -66.81 -29.74 69.75 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.677 -179.332 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.512 ' HA ' HD22 ' A' ' 74' ' ' LEU . 89.3 m -72.33 -49.77 31.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.717 0.807 . . . . 0.0 111.725 176.632 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.81 -32.25 72.68 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.107 0.563 . . . . 0.0 110.992 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.75 -41.17 88.22 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.312 0.645 . . . . 0.0 110.89 169.311 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.45 23.35 64.6 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.941 -172.869 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -158.57 158.73 29.69 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 125.221 1.408 . . . . 0.0 109.091 -167.745 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.553 ' HA ' ' HA ' ' A' ' 73' ' ' CYS . 19.4 Cg_endo -60.34 128.32 25.81 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.512 2.141 . . . . 0.0 112.253 172.94 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.8 t -106.54 140.07 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 124.425 1.09 . . . . 0.0 108.201 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -74.46 157.97 34.65 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 123.5 0.72 . . . . 0.0 110.854 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 34.3 tp -68.13 -44.9 75.05 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.355 1.062 . . . . 0.0 111.068 -174.114 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.12 -34.83 10.42 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 168.969 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.448 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 49.6 tt0 -85.91 -29.45 23.62 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.93 -25.95 68.37 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.677 0.391 . . . . 0.0 110.331 176.309 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.622 ' HA ' HD13 ' A' ' 51' ' ' LEU . 60.0 t -64.22 -51.43 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 122.991 0.516 . . . . 0.0 110.474 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -74.95 -47.16 30.9 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.603 0.565 . . . . 0.0 111.612 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.448 ' HG2' ' HG2' ' A' ' 39' ' ' GLN . 46.5 mm-40 -61.54 -49.41 76.82 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 59.1 m -82.1 -8.96 59.68 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 56.92 46.55 19.39 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.698 1.199 . . . . 0.0 111.955 176.94 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.36 146.8 26.28 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.778 178.543 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -54.72 150.04 38.01 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.116 2.544 . . . . 0.0 112.998 172.46 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.481 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.1 ttmt -50.29 -34.67 24.32 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.86 1.264 . . . . 0.0 111.99 175.834 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -53.29 -48.93 67.95 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.166 0.987 . . . . 0.0 112.009 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -66.25 -47.05 75.01 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.46 177.718 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.622 HD13 ' HA ' ' A' ' 41' ' ' VAL . 41.9 mt -59.84 -58.83 6.85 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.572 -173.549 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -52.66 -52.86 53.9 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 124.632 1.207 . . . . 0.0 112.074 -174.635 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.18 -37.07 76.48 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.028 0.83 . . . . 0.0 111.614 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.475 HG21 HD13 ' A' ' 20' ' ' LEU . 87.9 t -73.09 -41.98 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 173.351 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.7 -37.21 78.21 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.405 1.082 . . . . 0.0 113.693 -175.7 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -73.21 -27.64 61.73 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 118.652 0.66 . . . . 0.0 110.691 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.407 ' HG2' ' O ' ' A' ' 54' ' ' VAL . 4.1 ptt180 -70.79 -44.97 65.53 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.201 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.481 ' HE1' HG11 ' A' ' 64' ' ' VAL . 92.6 mtp -66.88 -37.88 85.25 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 124.419 1.088 . . . . 0.0 111.116 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.4 -38.62 90.51 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.678 0.391 . . . . 0.0 110.338 178.599 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.97 -27.63 67.61 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.663 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -91.33 8.73 34.67 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.983 0.913 . . . . 0.0 112.39 176.954 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 63.44 17.16 10.12 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 123.806 0.842 . . . . 0.0 112.263 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.576 ' HB3' HD21 ' A' ' 25' ' ' LEU . 98.3 mttt -82.27 -34.91 28.54 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 124.124 0.97 . . . . 0.0 111.4 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.481 HG11 ' HE1' ' A' ' 58' ' ' MET . 18.8 m -132.85 162.53 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.227 0.611 . . . . 0.0 109.997 176.845 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.6 m -131.06 142.95 50.34 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.411 0.684 . . . . 0.0 109.543 175.619 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 41.8 tp -92.51 101.08 13.52 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 175.755 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 31.9 p -85.13 -37.25 20.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.835 0.854 . . . . 0.0 111.667 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.534 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 15.9 t -140.32 155.1 70.3 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_exo -26.84 -59.51 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.52 1 C-N-CA 125.356 4.037 . . . . 0.0 116.865 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -120.05 42.06 3.03 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 111.178 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.534 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 34.1 m -131.95 126.7 34.69 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 123.239 0.616 . . . . 0.0 109.657 174.969 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -120.87 140.77 51.33 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.228 1.011 . . . . 0.0 109.064 -172.842 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 50.8 t -117.9 162.74 17.63 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 123.833 0.853 . . . . 0.0 110.168 -175.962 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.512 HD22 ' HA ' ' A' ' 29' ' ' THR . 41.3 tp -69.78 105.69 2.85 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 172.6 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -77.12 -43.39 16.83 Favored Glycine 0 C--N 1.335 0.502 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 171.723 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 169.86 113.65 0.29 Allowed Glycine 0 C--N 1.345 1.03 0 CA-C-N 115.031 -0.584 . . . . 0.0 112.172 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.488 ' HA ' HD23 ' A' ' 25' ' ' LEU . 86.4 m -66.16 97.02 0.36 Allowed 'General case' 0 C--O 1.242 0.681 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.848 . . . . . . . . 2 2 . 1 . 005 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.5 t70 64.82 78.24 0.27 Allowed Pre-proline 0 CA--C 1.555 1.142 0 O-C-N 124.498 1.124 . . . . 0.0 109.483 -175.11 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -75.49 159.4 39.62 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.54 2.16 . . . . 0.0 112.786 -177.653 . . . . . . . . 1 1 . 1 . 005 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 . . . . . 0 C--O 1.248 0.976 0 C-N-CA 123.995 0.918 . . . . 0.0 109.975 178.98 . . . . . . . . 0 0 . 1 . 006 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.406 ' SD ' ' N ' ' A' ' 2' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 111.393 0.145 . . . . 0.0 111.393 . . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.406 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -111.94 -55.89 0.47 Allowed Glycine 0 C--N 1.352 1.437 0 N-CA-C 112.289 -0.325 . . . . 0.0 112.289 -176.596 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -67.12 106.87 2.11 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.071 0.948 . . . . 0.0 110.634 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 63.15 52.22 2.56 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 124.321 1.013 . . . . 0.0 109.356 -174.716 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -63.2 122.59 16.52 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.314 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -95.43 -41.32 9.04 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.283 0.633 . . . . 0.0 109.988 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -142.03 153.36 44.18 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.998 0.919 . . . . 0.0 109.004 178.015 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 26.8 p80 -76.07 87.74 2.98 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-O 122.059 0.933 . . . . 0.0 109.583 175.715 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 43.1 t -152.64 139.15 18.64 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.152 0.981 . . . . 0.0 110.401 -177.527 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -85.03 -77.25 0.29 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.866 0.866 . . . . 0.0 109.348 174.219 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 67.1 mtt -147.45 -73.63 0.2 Allowed 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.235 1.014 . . . . 0.0 108.413 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.5 -41.38 7.79 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.039 0.936 . . . . 0.0 109.66 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 69.32 168.96 0.12 Allowed Pre-proline 0 N--CA 1.49 1.55 0 C-N-CA 124.679 1.192 . . . . 0.0 111.431 178.698 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -69.55 11.75 0.36 Allowed 'Trans proline' 0 C--N 1.394 2.968 0 C-N-CA 122.933 2.422 . . . . 0.0 114.353 -175.499 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 63.22 158.71 0.18 Allowed Glycine 0 C--N 1.35 1.314 0 N-CA-C 114.459 0.543 . . . . 0.0 114.459 -172.023 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.458 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 99.7 mtt180 -62.1 -36.92 83.17 Favored 'General case' 0 C--O 1.215 -0.739 0 O-C-N 122.626 -0.337 . . . . 0.0 110.537 172.872 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.06 -45.8 63.12 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 123.717 0.636 . . . . 0.0 112.363 -177.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.09 -36.84 94.01 Favored Glycine 0 C--N 1.348 1.224 0 N-CA-C 113.747 0.259 . . . . 0.0 113.747 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -71.58 -39.26 70.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.68 0.392 . . . . 0.0 110.287 177.237 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 51' ' ' LEU . 2.0 tm? -63.24 -46.5 86.64 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.758 1.223 . . . . 0.0 109.566 177.625 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.462 ' HG3' ' HE2' ' A' ' 58' ' ' MET . 35.9 tt0 -63.51 -47.18 82.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.624 1.169 . . . . 0.0 110.306 -178.909 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -63.21 -39.04 93.5 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.454 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.429 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -64.59 -43.27 94.35 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.0 0.52 . . . . 0.0 110.237 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.406 HG13 ' O ' ' A' ' 20' ' ' LEU . 87.5 mt -58.43 -52.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 123.977 0.798 . . . . 0.0 110.076 177.04 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.528 HD21 ' HB3' ' A' ' 63' ' ' LYS . 96.0 mt -56.8 -38.45 72.58 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.599 0.76 . . . . 0.0 111.01 -178.058 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -65.17 -48.91 71.83 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.316 1.01 . . . . 0.0 110.99 -178.885 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 23' ' ' ARG . 93.5 t -57.55 -41.71 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.596 0.758 . . . . 0.0 110.825 177.999 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.586 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 85.4 mt -63.95 -38.92 92.84 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.953 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.2 m -69.69 -46.12 66.76 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 123.616 0.766 . . . . 0.0 111.495 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.19 -38.31 90.65 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.527 0.731 . . . . 0.0 110.942 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.38 -44.19 83.78 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.509 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 20.19 66.89 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.194 -173.053 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 54.9 p -159.92 153.79 19.48 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.915 1.286 . . . . 0.0 109.155 -168.647 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.48 123.53 9.38 Favored 'Trans proline' 0 C--N 1.378 2.114 0 C-N-CA 123.65 2.9 . . . . 0.0 114.155 -178.368 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.3 t -108.51 129.73 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 124.626 1.171 . . . . 0.0 108.611 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.408 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 61.0 mttp -70.52 153.55 42.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.994 0.518 . . . . 0.0 110.66 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.46 ' O ' HG23 ' A' ' 41' ' ' VAL . 53.5 tp -59.76 -48.11 83.0 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 123.885 0.74 . . . . 0.0 109.993 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.31 -41.64 19.56 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.576 1.15 . . . . 0.0 113.071 170.146 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.416 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 53.4 tt0 -73.29 -37.68 66.14 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 122.933 0.493 . . . . 0.0 110.734 178.752 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.41 -34.97 73.11 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.361 0.664 . . . . 0.0 110.466 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.46 HG23 ' O ' ' A' ' 37' ' ' LEU . 35.9 t -56.88 -56.64 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.642 0.777 . . . . 0.0 111.711 176.365 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -69.29 -37.96 78.08 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 123.726 0.641 . . . . 0.0 111.735 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.416 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 29.7 mm-40 -63.75 -55.82 20.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.098 0.559 . . . . 0.0 111.911 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 41.8 t -76.95 -18.43 58.25 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 122.778 0.431 . . . . 0.0 110.792 -174.457 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 62.21 23.78 14.1 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.942 1.297 . . . . 0.0 110.996 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.19 153.15 49.77 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.554 1.142 . . . . 0.0 109.829 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.475 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 10.5 Cg_endo -54.37 131.16 43.72 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.032 2.488 . . . . 0.0 112.45 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -42.51 -44.89 4.28 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.168 1.387 . . . . 0.0 113.488 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.408 ' HG3' ' N ' ' A' ' 50' ' ' GLU . 47.7 ptt85 -57.66 -39.93 78.16 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 123.765 0.666 . . . . 0.0 111.829 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.475 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 6.2 tp10 -66.53 -49.38 66.69 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 123.566 0.746 . . . . 0.0 109.933 -178.568 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.585 ' HA ' HD11 ' A' ' 20' ' ' LEU . 22.3 mt -58.56 -57.21 13.95 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.666 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.471 ' HA ' HD12 ' A' ' 55' ' ' LEU . 22.0 t-20 -50.47 -53.74 27.43 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.697 1.599 . . . . 0.0 112.402 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -58.0 -49.39 77.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.248 0.619 . . . . 0.0 111.702 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.476 HG13 ' SD ' ' A' ' 58' ' ' MET . 70.3 t -63.91 -37.57 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.383 0.673 . . . . 0.0 110.675 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.471 HD12 ' HA ' ' A' ' 52' ' ' ASN . 32.1 mt -54.08 -35.2 61.82 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.441 1.096 . . . . 0.0 112.751 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.401 ' O ' ' HG3' ' A' ' 60' ' ' LYS . 59.1 m-85 -69.93 -34.55 73.61 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.466 0.576 . . . . 0.0 111.782 178.247 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -66.7 -49.25 66.68 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.476 ' SD ' HG13 ' A' ' 54' ' ' VAL . 72.4 mtp -62.0 -36.01 80.23 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.263 1.025 . . . . 0.0 111.335 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -64.44 -39.58 94.09 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.943 0.897 . . . . 0.0 111.78 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.401 ' HG3' ' O ' ' A' ' 56' ' ' TYR . 88.5 mttt -67.72 -25.94 65.91 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.316 0.646 . . . . 0.0 111.453 175.559 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -89.53 4.74 48.3 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.56 0.744 . . . . 0.0 110.616 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 62.18 13.61 5.98 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.136 1.375 . . . . 0.0 112.642 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.528 ' HB3' HD21 ' A' ' 25' ' ' LEU . 94.5 mttt -66.5 -39.45 88.71 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.352 1.061 . . . . 0.0 110.431 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.468 HG11 ' HE3' ' A' ' 58' ' ' MET . 30.1 m -125.47 160.78 31.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-N 114.856 -1.065 . . . . 0.0 108.9 175.562 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.547 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 70.8 m -137.68 143.82 41.5 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.995 0.918 . . . . 0.0 108.705 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.6 101.0 12.54 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 t -92.94 -33.68 14.08 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.014 -171.646 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.673 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 18.5 m -139.07 162.71 50.76 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.079 0.952 . . . . 0.0 108.717 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.67 111.74 0.77 Allowed 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 122.941 2.428 . . . . 0.0 113.281 178.441 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 63.79 26.37 14.37 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.79 1.236 . . . . 0.0 111.538 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.673 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 87.5 m -130.2 125.6 35.33 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.769 0.828 . . . . 0.0 108.927 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -113.46 171.28 7.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.133 0.973 . . . . 0.0 109.449 -172.102 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.547 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 20.0 p -152.6 160.12 43.21 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.606 0.763 . . . . 0.0 109.008 177.868 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.586 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 26.1 tp -78.05 101.86 7.15 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -84.35 -39.62 8.98 Favored Glycine 0 C--N 1.341 0.806 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -93.04 58.5 2.42 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-N 114.811 -0.695 . . . . 0.0 111.472 177.131 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.2 t -75.86 88.57 2.87 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.029 0.932 . . . . 0.0 110.024 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 t70 51.5 73.51 0.96 Allowed Pre-proline 0 N--CA 1.48 1.04 0 C-N-CA 124.067 0.947 . . . . 0.0 110.59 -172.697 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -77.35 148.54 26.85 Favored 'Trans proline' 0 C--N 1.37 1.663 0 C-N-CA 122.455 2.103 . . . . 0.0 112.27 -175.012 . . . . . . . . 1 1 . 1 . 006 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 . . . . . 0 C--O 1.252 1.231 0 C-N-CA 123.468 0.707 . . . . 0.0 110.654 -179.128 . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 007 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 87.57 83.55 1.19 Allowed Glycine 0 C--N 1.35 1.348 0 CA-C-N 116.32 -0.4 . . . . 0.0 112.645 176.526 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -57.61 -37.64 73.59 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.671 0.788 . . . . 0.0 110.782 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -81.18 99.44 8.56 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.579 173.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -70.45 119.8 15.16 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.649 0.78 . . . . 0.0 109.928 -175.971 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -63.46 98.71 0.18 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.068 0.947 . . . . 0.0 110.732 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -141.17 106.23 4.98 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.3 m170 55.58 37.57 29.06 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.281 1.032 . . . . 0.0 110.172 -175.564 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.6 m -66.97 96.8 0.45 Allowed 'General case' 0 C--N 1.351 0.665 0 C-N-CA 124.195 0.998 . . . . 0.0 110.878 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.8 t-80 -161.43 140.83 10.21 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.2 mtm -77.32 116.26 17.77 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.82 97.19 0.21 Allowed 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.596 0.56 . . . . 0.0 110.258 -178.062 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -73.86 139.64 77.05 Favored Pre-proline 0 C--O 1.241 0.653 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.924 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.11 142.35 55.74 Favored 'Trans proline' 0 C--N 1.363 1.326 0 C-N-CA 122.048 1.832 . . . . 0.0 111.608 175.085 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -46.64 -78.02 0.09 OUTLIER Glycine 0 C--N 1.358 1.775 0 O-C-N 124.101 0.876 . . . . 0.0 115.132 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -57.29 -59.85 4.5 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 117.417 0.608 . . . . 0.0 111.784 176.924 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -65.01 -53.31 48.17 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.772 -0.633 . . . . 0.0 111.738 -166.16 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.69 -48.98 73.35 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-O 119.858 -0.412 . . . . 0.0 114.091 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -66.52 -47.34 73.23 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.989 0.515 . . . . 0.0 111.583 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.574 HD13 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -63.36 -40.54 97.55 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.72 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.1 tt0 -61.83 -48.36 80.9 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.572 1.149 . . . . 0.0 110.354 177.737 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -57.76 -41.08 81.2 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.484 0.713 . . . . 0.0 109.928 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.425 ' O ' HG23 ' A' ' 27' ' ' VAL . 20.2 mmm180 -68.28 -44.63 75.12 Favored 'General case' 0 C--N 1.352 0.695 0 C-N-CA 123.541 0.737 . . . . 0.0 112.398 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.474 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 53.9 mt -59.83 -50.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.137 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.428 ' HG ' ' O ' ' A' ' 21' ' ' GLU . 79.4 mt -63.92 -33.45 75.73 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.756 0.66 . . . . 0.0 110.744 -176.703 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -69.09 -43.72 73.93 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.469 0.708 . . . . 0.0 110.594 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.425 HG23 ' O ' ' A' ' 23' ' ' ARG . 72.8 t -62.66 -34.94 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.537 178.199 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.474 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 78.3 mt -66.62 -37.34 84.65 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.211 175.214 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -67.37 -52.72 36.65 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 124.193 0.997 . . . . 0.0 111.599 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -69.79 -31.46 69.4 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.102 0.561 . . . . 0.0 111.7 -171.094 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.94 -38.34 90.64 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.751 167.484 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.07 25.3 70.84 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.521 -175.711 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.6 p -161.17 159.75 24.33 Favored Pre-proline 0 C--O 1.245 0.859 0 C-N-CA 125.25 1.42 . . . . 0.0 109.105 -172.421 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.98 126.16 21.31 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.109 1.873 . . . . 0.0 112.773 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 89.3 t -104.03 138.38 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.126 0.97 . . . . 0.0 108.663 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -73.9 152.15 40.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.409 ' O ' HG23 ' A' ' 41' ' ' VAL . 26.2 tp -61.86 -46.51 89.11 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.859 0.863 . . . . 0.0 109.846 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.45 -45.05 3.06 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.902 1.281 . . . . 0.0 112.816 167.13 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 62.3 tt0 -79.79 -30.55 40.66 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.911 0.484 . . . . 0.0 111.034 -178.802 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.97 -30.82 71.87 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.161 0.584 . . . . 0.0 110.997 178.269 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.498 ' HA ' HD11 ' A' ' 51' ' ' LEU . 64.4 t -55.75 -56.35 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.692 0.797 . . . . 0.0 112.024 176.887 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 63.2 pttt -68.85 -42.44 77.12 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 123.567 0.542 . . . . 0.0 111.668 -175.285 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -66.92 -49.39 65.68 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.516 0.727 . . . . 0.0 112.089 -177.505 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 56.9 m -81.35 -9.94 59.64 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 122.376 0.271 . . . . 0.0 110.805 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 60.13 29.49 19.05 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.481 1.112 . . . . 0.0 111.401 175.87 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.7 156.06 65.45 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 123.525 0.73 . . . . 0.0 111.003 -173.844 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.62 133.0 32.67 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.644 2.229 . . . . 0.0 111.938 174.275 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.402 ' HA ' HD13 ' A' ' 51' ' ' LEU . 40.0 ttmt -46.97 -36.69 8.01 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.959 1.303 . . . . 0.0 113.072 174.91 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.0 mtm180 -54.6 -49.09 71.27 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.665 0.786 . . . . 0.0 110.957 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -67.15 -46.96 72.49 Favored 'General case' 0 C--O 1.25 1.126 0 C-N-CA 123.891 0.876 . . . . 0.0 110.659 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.498 HD11 ' HA ' ' A' ' 41' ' ' VAL . 95.9 mt -53.68 -51.74 62.25 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.997 0.919 . . . . 0.0 111.496 -176.811 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -53.47 -50.99 64.15 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 124.621 1.201 . . . . 0.0 112.444 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -57.07 -39.88 75.81 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.993 0.808 . . . . 0.0 111.269 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.574 HG21 HD13 ' A' ' 20' ' ' LEU . 98.2 t -71.49 -43.79 71.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.567 0.747 . . . . 0.0 110.993 176.098 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.454 HD11 ' NE1' ' A' ' 72' ' ' TRP . 79.6 mt -54.04 -45.05 71.53 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.474 1.109 . . . . 0.0 113.368 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.78 -25.4 59.04 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.112 0.414 . . . . 0.0 111.534 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -68.37 -53.52 23.4 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.72 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 68.7 mtm -60.79 -31.86 71.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.995 0.918 . . . . 0.0 110.987 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -62.62 -46.81 86.55 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.828 0.851 . . . . 0.0 110.861 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.603 ' HB2' ' HZ3' ' A' ' 60' ' ' LYS . 4.9 ttmp? -68.18 -26.11 65.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.443 0.697 . . . . 0.0 111.418 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -90.4 -0.0 57.46 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.314 0.646 . . . . 0.0 111.516 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 67.75 10.99 8.16 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 124.928 1.291 . . . . 0.0 112.845 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.533 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.1 mttt -69.51 -28.24 65.88 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.656 0.783 . . . . 0.0 111.04 174.285 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.0 161.23 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.544 0.738 . . . . 0.0 110.048 171.822 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.7 m -139.08 152.21 47.34 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.75 0.82 . . . . 0.0 108.876 172.814 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.7 tp -101.25 106.96 18.22 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.2 p -92.97 -39.79 10.92 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.636 0.775 . . . . 0.0 111.178 -175.063 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.524 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 25.3 m -140.68 167.04 18.97 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 123.854 0.861 . . . . 0.0 109.249 -173.879 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.71 112.43 0.69 Allowed 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 123.124 2.549 . . . . 0.0 113.429 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 62.63 18.96 10.98 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.372 1.069 . . . . 0.0 112.856 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.524 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 31.4 m -119.78 123.17 43.07 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 123.574 0.75 . . . . 0.0 110.0 -174.506 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.454 ' NE1' HD11 ' A' ' 55' ' ' LEU . 62.5 m95 -119.32 151.63 38.12 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.339 1.055 . . . . 0.0 109.614 -169.841 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 24.4 p -128.22 157.03 41.98 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 109.337 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.43 ' HB3' ' HB ' ' A' ' 77' ' ' THR . 46.3 tp -77.61 131.19 37.68 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.937 0.495 . . . . 0.0 110.839 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.3 77.92 0.85 Allowed Glycine 0 C--N 1.349 1.281 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 171.69 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.79 -23.67 0.82 Allowed Glycine 0 C--N 1.337 0.602 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -170.342 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.43 ' HB ' ' HB3' ' A' ' 74' ' ' LEU . 12.6 m -129.4 56.01 1.73 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 173.321 . . . . . . . . 2 2 . 1 . 007 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.35 151.33 92.02 Favored Pre-proline 0 N--CA 1.485 1.295 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.111 -177.139 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -58.71 117.08 3.74 Favored 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 122.93 2.42 . . . . 0.0 113.495 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 . . . . . 0 C--O 1.254 1.293 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.429 . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 N--CA 1.485 1.311 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 . . . . . . . . . 0 0 . 1 . 008 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -177.42 101.12 0.15 Allowed Glycine 0 C--N 1.347 1.145 0 C-N-CA 121.423 -0.418 . . . . 0.0 113.303 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -115.85 153.85 30.75 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.433 0.693 . . . . 0.0 109.525 173.414 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -71.35 106.96 4.07 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.859 0.864 . . . . 0.0 109.467 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -89.51 -58.15 2.63 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 123.591 0.557 . . . . 0.0 110.423 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -119.44 124.4 46.43 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.804 0.842 . . . . 0.0 110.477 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -67.98 140.59 56.4 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.411 1.084 . . . . 0.0 109.834 174.581 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -57.38 97.21 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.486 0.715 . . . . 0.0 110.595 178.622 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.0 t -164.05 119.29 1.55 Allowed 'General case' 0 C--O 1.235 0.297 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.9 t-80 -62.26 98.27 0.11 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.356 0.662 . . . . 0.0 110.91 -173.358 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.7 mtt 60.75 -83.76 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.809 0 O-C-N 124.87 1.356 . . . . 0.0 110.521 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.14 19.98 5.24 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.594 1.157 . . . . 0.0 113.077 174.973 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -137.67 71.84 50.39 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 124.077 0.951 . . . . 0.0 108.58 -172.126 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -90.15 -2.55 5.43 Favored 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.35 2.7 . . . . 0.0 114.331 -174.087 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -47.15 -83.71 0.02 OUTLIER Glycine 0 C--N 1.352 1.43 0 N-CA-C 115.306 0.882 . . . . 0.0 115.306 177.809 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.8 mtm105 -54.86 -45.38 74.56 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.893 0.877 . . . . 0.0 111.456 -176.259 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -67.7 -46.04 73.39 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 124.645 1.215 . . . . 0.0 112.103 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.32 -38.86 96.94 Favored Glycine 0 C--N 1.342 0.878 0 O-C-N 123.392 0.433 . . . . 0.0 113.012 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.5 m-70 -73.43 -36.21 65.9 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.191 0.52 . . . . 0.0 110.52 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.521 HD13 HG21 ' A' ' 54' ' ' VAL . 2.0 tm? -65.82 -42.53 90.49 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.304 1.042 . . . . 0.0 110.148 174.631 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.454 ' HG3' ' HE1' ' A' ' 58' ' ' MET . 40.2 tt0 -61.35 -42.8 99.28 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.787 0.835 . . . . 0.0 109.898 177.655 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -42.54 93.92 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.948 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.415 ' O ' HG22 ' A' ' 27' ' ' VAL . 12.7 tpt180 -67.16 -42.27 84.59 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.137 -177.791 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 78.5 mt -57.01 -49.61 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 O-C-N 123.909 0.756 . . . . 0.0 109.876 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.572 HD23 ' HB3' ' A' ' 63' ' ' LYS . 92.0 mt -59.24 -39.59 83.25 Favored 'General case' 0 C--N 1.349 0.547 0 O-C-N 123.987 0.804 . . . . 0.0 111.142 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -66.62 -45.44 79.1 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.667 0.605 . . . . 0.0 110.911 -176.777 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.415 HG22 ' O ' ' A' ' 23' ' ' ARG . 86.6 t -56.34 -42.83 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.289 0.636 . . . . 0.0 110.279 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 97.8 mt -71.9 -34.59 69.25 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.635 -177.906 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.434 ' HA ' HD23 ' A' ' 74' ' ' LEU . 27.3 m -70.63 -45.65 64.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.314 0.646 . . . . 0.0 111.68 179.518 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.1 -33.17 74.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.913 0.485 . . . . 0.0 110.867 -177.239 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.68 -44.88 66.11 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.705 0.628 . . . . 0.0 110.345 172.024 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.42 25.52 67.0 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.782 -170.245 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.7 m -148.41 155.29 42.46 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 124.082 0.953 . . . . 0.0 110.314 -166.999 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -60.53 109.21 0.61 Allowed 'Trans proline' 0 C--N 1.368 1.564 0 C-N-CA 123.063 2.509 . . . . 0.0 112.089 169.567 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.5 t -97.12 130.65 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.991 0.916 . . . . 0.0 108.531 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.64 153.29 43.64 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.472 ' O ' HG21 ' A' ' 41' ' ' VAL . 36.1 tp -59.18 -45.46 90.99 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.991 0.807 . . . . 0.0 110.23 -178.276 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.58 -47.27 10.29 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.362 1.065 . . . . 0.0 112.94 170.213 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.431 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.9 tt0 -77.32 -34.89 55.27 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.002 0.521 . . . . 0.0 110.397 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.8 mt -56.76 -41.51 77.72 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.618 0.767 . . . . 0.0 110.591 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.474 ' HA ' HD13 ' A' ' 51' ' ' LEU . 92.1 t -53.59 -56.34 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 124.243 0.965 . . . . 0.0 111.635 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -74.59 -35.18 62.99 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.27 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.431 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 13.7 mm-40 -69.98 -45.86 66.44 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 122.713 0.405 . . . . 0.0 112.088 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.548 ' SG ' HD23 ' A' ' 51' ' ' LEU . 23.8 p -72.6 -19.66 61.43 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.399 0.279 . . . . 0.0 111.042 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 64.8 37.84 7.1 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 124.292 1.037 . . . . 0.0 110.106 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.534 ' HB2' ' SG ' ' A' ' 44' ' ' CYS . . . -134.64 159.45 72.16 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.679 -173.213 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.71 134.81 22.68 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.426 2.084 . . . . 0.0 111.95 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.402 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.3 ttmt -50.21 -31.84 14.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.669 1.188 . . . . 0.0 113.086 175.068 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -61.03 -48.64 80.84 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 122.622 0.369 . . . . 0.0 111.183 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -65.86 -46.61 77.8 Favored 'General case' 0 C--O 1.242 0.691 0 O-C-N 123.772 0.67 . . . . 0.0 110.55 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.548 HD23 ' SG ' ' A' ' 44' ' ' CYS . 93.8 mt -55.06 -58.61 6.95 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 124.267 0.98 . . . . 0.0 110.746 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -48.13 -53.24 17.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.658 1.583 . . . . 0.0 112.216 -174.497 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -56.52 -48.83 76.4 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 123.945 0.778 . . . . 0.0 112.423 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.583 HG12 ' SD ' ' A' ' 58' ' ' MET . 70.1 t -63.63 -43.73 98.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 123.734 0.647 . . . . 0.0 110.726 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 77.0 mt -50.7 -43.9 57.9 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.237 1.415 . . . . 0.0 113.739 -177.335 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.455 ' O ' ' HG3' ' A' ' 60' ' ' LYS . 92.5 m-85 -73.1 -30.92 64.0 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.508 0.595 . . . . 0.0 112.21 -178.985 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.4 ttt85 -74.02 -51.99 14.13 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.443 0.297 . . . . 0.0 110.209 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.583 ' SD ' HG12 ' A' ' 54' ' ' VAL . 19.7 ptm -65.82 -19.26 65.82 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.137 0.575 . . . . 0.0 110.812 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -65.46 -44.31 87.6 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.555 0.742 . . . . 0.0 110.759 171.49 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.455 ' HG3' ' O ' ' A' ' 56' ' ' TYR . 61.3 mttm -66.35 -31.68 72.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.637 0.775 . . . . 0.0 110.826 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -84.45 6.24 24.19 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.227 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.81 10.93 7.24 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.872 1.269 . . . . 0.0 112.305 176.441 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.572 ' HB3' HD23 ' A' ' 25' ' ' LEU . 92.3 mttt -70.85 -34.97 72.19 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.586 0.754 . . . . 0.0 110.505 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.474 HG11 ' HE2' ' A' ' 58' ' ' MET . 16.4 m -133.64 160.33 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.289 0.635 . . . . 0.0 109.731 174.409 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.1 m -125.45 150.6 47.17 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.5 tp -104.49 104.67 14.56 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.1 p -87.73 -42.75 12.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.73 0.812 . . . . 0.0 110.896 -172.654 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.514 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 30.7 m -139.84 170.63 9.41 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.035 0.934 . . . . 0.0 109.486 -174.476 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.32 106.49 0.08 OUTLIER 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 123.418 2.746 . . . . 0.0 114.071 173.714 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.04 20.0 10.46 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.765 1.226 . . . . 0.0 112.626 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.514 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 34.6 m -114.64 118.47 33.76 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.61 0.764 . . . . 0.0 109.153 -174.84 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 58.3 m95 -116.92 139.15 50.98 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.948 0.899 . . . . 0.0 109.314 -169.572 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 45.8 t -117.38 165.08 13.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.029 0.532 . . . . 0.0 109.902 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.434 HD23 ' HA ' ' A' ' 29' ' ' THR . 45.5 tp -65.93 111.64 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 122.969 0.508 . . . . 0.0 110.112 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.6 -40.67 12.25 Favored Glycine 0 N--CA 1.465 0.57 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 175.303 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -89.91 83.75 1.37 Allowed Glycine 0 C--N 1.343 0.926 0 CA-C-O 119.721 -0.488 . . . . 0.0 111.963 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 32.5 m -56.89 100.79 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.698 0.799 . . . . 0.0 111.42 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -62.18 129.24 91.99 Favored Pre-proline 0 N--CA 1.472 0.674 0 C-N-CA 123.311 0.645 . . . . 0.0 110.857 177.8 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -78.43 44.46 1.63 Allowed 'Trans proline' 0 C--N 1.368 1.6 0 C-N-CA 123.036 2.49 . . . . 0.0 112.759 177.119 . . . . . . . . 1 1 . 1 . 008 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 . . . . . 0 CA--C 1.557 1.242 0 C-N-CA 124.35 1.06 . . . . 0.0 109.559 -177.734 . . . . . . . . 0 0 . 1 . 009 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.432 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.2 mpt? . . . . . 0 N--CA 1.487 1.378 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.87 32.14 7.87 Favored Glycine 0 C--N 1.347 1.175 0 O-C-N 123.315 0.385 . . . . 0.0 113.141 178.523 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -82.13 -32.03 30.31 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.215 0.606 . . . . 0.0 111.476 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 44.2 m80 69.17 20.83 7.45 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.956 1.302 . . . . 0.0 111.36 -174.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -97.85 87.23 3.95 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.509 0.723 . . . . 0.0 109.406 -177.9 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -113.68 105.62 13.52 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.787 0.835 . . . . 0.0 109.872 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -157.07 140.96 16.14 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 176.289 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -58.16 -33.62 69.4 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -174.037 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.9 p -74.96 77.76 2.18 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 122.956 0.502 . . . . 0.0 111.306 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.3 p80 -73.19 75.62 1.29 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.752 0.821 . . . . 0.0 109.196 176.463 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.6 ttm 66.38 -70.92 0.1 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.919 1.287 . . . . 0.0 108.572 -160.906 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -169.28 152.75 5.05 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.433 1.093 . . . . 0.0 109.661 174.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -72.78 143.5 84.62 Favored Pre-proline 0 N--CA 1.478 0.929 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 165.508 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -64.67 80.45 0.18 Allowed 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 123.074 2.516 . . . . 0.0 113.019 -175.773 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -28.65 95.46 0.01 OUTLIER Glycine 0 C--N 1.357 1.731 0 C-N-CA 125.566 1.555 . . . . 0.0 114.813 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 -52.97 -12.04 0.29 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -170.71 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -51.95 -52.66 48.77 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.186 0.994 . . . . 0.0 112.769 -163.806 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.4 99.75 Favored Glycine 0 C--N 1.351 1.378 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -69.21 -45.65 69.36 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -177.231 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.526 HD11 HD23 ' A' ' 51' ' ' LEU . 2.6 tm? -64.69 -37.26 86.98 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.125 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.552 ' HG3' ' HE2' ' A' ' 58' ' ' MET . 38.1 tt0 -60.91 -50.85 71.76 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.235 1.014 . . . . 0.0 110.461 175.792 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -62.62 -31.87 72.79 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 124.617 1.198 . . . . 0.0 110.559 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -71.35 -44.11 65.68 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.11 0.564 . . . . 0.0 111.311 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.559 ' HB ' ' HE3' ' A' ' 58' ' ' MET . 79.5 mt -60.53 -47.41 92.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 177.094 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.67 -36.05 73.54 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.678 0.791 . . . . 0.0 110.66 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -65.45 -48.71 71.78 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.034 0.834 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 71.4 t -58.56 -39.42 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.883 0.873 . . . . 0.0 110.752 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -68.46 -38.89 81.5 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.098 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 67.5 m -72.18 -45.69 59.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.526 0.73 . . . . 0.0 111.991 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.16 -38.76 91.58 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.042 0.537 . . . . 0.0 110.969 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.83 83.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.414 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 67.2 22.53 72.72 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.322 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.1 p -151.39 166.73 14.49 Favored Pre-proline 0 C--O 1.246 0.901 0 C-N-CA 123.999 0.92 . . . . 0.0 109.697 -169.76 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.18 118.51 5.41 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.424 2.083 . . . . 0.0 111.918 171.345 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 99.1 t -102.5 125.29 56.8 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.516 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 67.2 mttm -69.52 155.08 41.04 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.981 0.512 . . . . 0.0 110.523 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.42 ' O ' HG21 ' A' ' 41' ' ' VAL . 33.4 tp -61.19 -49.75 75.92 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.419 0.688 . . . . 0.0 110.726 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.83 -38.37 15.81 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.841 0.857 . . . . 0.0 112.578 171.439 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.466 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 62.5 tt0 -75.36 -38.88 59.81 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 122.795 0.438 . . . . 0.0 110.574 176.785 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.412 ' O ' ' SG ' ' A' ' 44' ' ' CYS . 56.8 mt -56.98 -40.59 76.81 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.422 0.689 . . . . 0.0 110.641 -179.241 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.42 HG21 ' O ' ' A' ' 37' ' ' LEU . 51.7 t -55.22 -54.07 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 123.962 0.789 . . . . 0.0 111.639 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -69.53 -39.01 77.75 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.241 0.338 . . . . 0.0 111.375 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.466 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 46.6 mm-40 -64.35 -53.67 45.06 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.601 ' SG ' HD22 ' A' ' 51' ' ' LEU . 31.6 p -76.92 -24.45 52.44 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 122.721 0.408 . . . . 0.0 111.132 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 63.3 36.61 11.6 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.107 0.963 . . . . 0.0 110.919 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.405 ' HB2' ' SG ' ' A' ' 44' ' ' CYS . . . -118.81 150.47 48.51 Favored Pre-proline 0 C--O 1.242 0.697 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.394 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.08 135.84 45.5 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.207 1.938 . . . . 0.0 111.437 177.52 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -50.02 -33.28 17.58 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.683 1.193 . . . . 0.0 112.64 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -61.54 -45.06 95.77 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.581 0.752 . . . . 0.0 111.74 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -65.0 -50.16 67.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.618 0.767 . . . . 0.0 110.387 174.173 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.601 HD22 ' SG ' ' A' ' 44' ' ' CYS . 97.0 mt -53.95 -58.89 5.63 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 124.201 1.0 . . . . 0.0 112.01 -176.896 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.455 ' HA ' HD13 ' A' ' 55' ' ' LEU . 5.3 m-20 -55.7 -46.43 77.68 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.554 1.159 . . . . 0.0 111.953 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -54.08 -48.82 70.25 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 123.853 0.721 . . . . 0.0 110.691 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.554 HG12 ' HE1' ' A' ' 58' ' ' MET . 56.9 t -70.15 -36.08 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.101 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.455 HD13 ' HA ' ' A' ' 52' ' ' ASN . 57.7 mt -53.55 -42.92 68.01 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.437 1.095 . . . . 0.0 113.649 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -72.62 -27.17 61.99 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 118.681 0.673 . . . . 0.0 111.405 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -67.35 -58.58 4.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.662 0.785 . . . . 0.0 110.473 176.01 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.559 ' HE3' ' HB ' ' A' ' 24' ' ' ILE . 14.4 ptp -61.56 -28.73 69.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.724 0.81 . . . . 0.0 111.561 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -65.89 -43.71 87.46 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 0.0 110.963 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.682 ' HZ1' ' HB2' ' A' ' 60' ' ' LYS . 5.0 ttmp? -63.35 -39.24 94.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.716 0.806 . . . . 0.0 111.008 174.638 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -82.78 4.15 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.231 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.6 mt 63.03 15.04 8.11 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.365 1.466 . . . . 0.0 112.553 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.72 -23.15 60.81 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 124.411 1.084 . . . . 0.0 110.433 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.484 HG11 ' SD ' ' A' ' 58' ' ' MET . 13.3 m -130.52 170.09 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.115 0.566 . . . . 0.0 109.933 171.386 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.8 t -135.0 153.37 52.11 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.345 173.277 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.0 tp -101.25 101.82 12.58 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 176.148 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.4 p -81.52 -41.68 21.34 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.965 0.506 . . . . 0.0 110.444 -176.165 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.547 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 42.3 t -140.21 152.3 66.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.644 0.778 . . . . 0.0 108.915 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.16 124.37 8.9 Favored 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.135 2.557 . . . . 0.0 112.431 168.378 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 69.31 9.53 7.36 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.155 1.382 . . . . 0.0 112.715 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.547 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 58.3 m -129.02 120.04 25.32 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.64 0.776 . . . . 0.0 109.264 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -107.15 166.81 10.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.732 0.813 . . . . 0.0 108.867 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.3 t -152.82 165.13 36.35 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.417 HD23 ' O ' ' A' ' 77' ' ' THR . 22.3 tp -71.12 148.39 47.47 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 176.711 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.27 85.77 0.24 Allowed Glycine 0 C--N 1.347 1.14 0 O-C-N 123.497 0.498 . . . . 0.0 112.256 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 110.21 -7.77 30.84 Favored Glycine 0 N--CA 1.461 0.316 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.417 ' O ' HD23 ' A' ' 74' ' ' LEU . 31.4 m 68.25 -55.45 0.51 Allowed 'General case' 0 C--N 1.36 1.022 0 C-N-CA 125.947 1.699 . . . . 0.0 110.878 -171.069 . . . . . . . . 2 2 . 1 . 009 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -121.26 96.46 48.09 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 166.666 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -58.16 157.08 26.77 Favored 'Trans proline' 0 C--N 1.374 1.91 0 C-N-CA 123.519 2.813 . . . . 0.0 114.562 -174.956 . . . . . . . . 1 1 . 1 . 009 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 . . . . . 0 C--O 1.251 1.155 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.374 . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.1 mtm . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 120.193 0.044 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 010 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.72 118.3 0.85 Allowed Glycine 0 C--N 1.342 0.907 0 N-CA-C 112.03 -0.428 . . . . 0.0 112.03 178.087 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 42.3 m-70 -131.61 -169.48 2.2 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.778 1.231 . . . . 0.0 108.414 171.01 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 58.12 69.91 0.69 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.069 0.948 . . . . 0.0 109.671 -174.446 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -53.89 144.14 19.51 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.306 0.642 . . . . 0.0 111.348 -177.153 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 24.1 m170 -68.46 125.91 27.96 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.373 0.669 . . . . 0.0 110.898 -173.489 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 t60 72.04 22.11 3.83 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 125.333 1.453 . . . . 0.0 111.345 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -70.95 99.88 1.86 Allowed 'General case' 0 C--N 1.357 0.934 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.045 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 m -94.44 147.05 23.63 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.691 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.8 m80 -111.7 20.6 16.94 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.779 0.831 . . . . 0.0 109.916 170.83 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.4 mmt 61.21 21.37 11.83 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.453 1.101 . . . . 0.0 110.763 -171.173 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.82 99.92 11.48 Favored 'General case' 0 C--N 1.346 0.425 0 C-N-CA 124.548 1.139 . . . . 0.0 108.2 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -108.16 99.81 33.53 Favored Pre-proline 0 C--O 1.241 0.621 0 C-N-CA 122.698 0.399 . . . . 0.0 110.397 -173.236 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -88.86 59.6 2.47 Favored 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.921 2.414 . . . . 0.0 109.074 168.232 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -45.97 -83.56 0.02 OUTLIER Glycine 0 C--N 1.355 1.638 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 -168.094 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.6 ttt-85 -56.91 -49.79 74.52 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.473 1.109 . . . . 0.0 112.598 -173.776 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.76 -48.71 79.46 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.483 0.713 . . . . 0.0 111.905 -177.412 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.41 74.26 Favored Glycine 0 C--N 1.345 1.058 0 O-C-N 123.971 0.794 . . . . 0.0 114.709 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -75.99 -38.68 57.12 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.186 0.594 . . . . 0.0 109.78 177.049 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.538 HD13 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -64.54 -43.64 93.34 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.712 176.529 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -65.55 -40.39 92.79 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.272 1.029 . . . . 0.0 110.043 176.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.0 -38.09 87.3 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.738 0.815 . . . . 0.0 110.223 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.429 ' O ' HG23 ' A' ' 27' ' ' VAL . 22.8 mmm180 -63.76 -50.83 67.5 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 122.737 0.415 . . . . 0.0 110.919 174.865 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 87.8 mt -56.1 -54.23 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 O-C-N 123.863 0.727 . . . . 0.0 110.354 -175.641 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.493 HD23 ' HB3' ' A' ' 63' ' ' LYS . 90.0 mt -65.01 -35.43 81.17 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.953 0.901 . . . . 0.0 111.486 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -66.09 -47.4 74.33 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.296 0.638 . . . . 0.0 110.328 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 23' ' ' ARG . 61.1 t -59.81 -40.9 83.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 124.516 1.126 . . . . 0.0 111.205 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.57 -38.65 87.52 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.742 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 73.5 m -68.73 -50.46 50.53 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.121 0.968 . . . . 0.0 111.776 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -67.44 -40.46 85.44 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.97 0.508 . . . . 0.0 110.994 -173.813 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -42.19 98.8 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.386 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.76 29.4 64.4 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 115.164 -0.926 . . . . 0.0 112.249 -174.779 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.2 m -150.94 153.89 33.71 Favored Pre-proline 0 C--O 1.242 0.665 0 C-N-CA 125.296 1.438 . . . . 0.0 107.897 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -60.98 114.05 2.0 Allowed 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.194 1.929 . . . . 0.0 111.382 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.7 t -96.23 128.21 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.357 1.063 . . . . 0.0 108.281 -176.284 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.541 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 49.0 mtmt -58.58 154.72 13.68 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.447 0.699 . . . . 0.0 111.397 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.5 tp -67.43 -50.74 58.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.017 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -53.67 -28.1 31.42 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -81.88 -30.64 31.87 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.909 0.484 . . . . 0.0 109.882 177.121 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.36 -26.38 67.24 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.138 0.575 . . . . 0.0 110.087 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.459 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.5 t -58.52 -53.23 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.498 0.719 . . . . 0.0 111.4 174.63 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -70.79 -40.72 72.38 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.887 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -69.46 -51.77 32.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.972 0.509 . . . . 0.0 112.128 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 57.2 m -78.03 -13.22 59.95 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.385 0.274 . . . . 0.0 110.789 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 60.38 31.39 20.36 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.008 1.323 . . . . 0.0 111.891 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.24 154.43 56.13 Favored Pre-proline 0 N--CA 1.473 0.681 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.501 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.427 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 11.4 Cg_endo -56.12 136.72 76.56 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.81 2.34 . . . . 0.0 111.632 169.999 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.407 ' HA ' HD13 ' A' ' 51' ' ' LEU . 26.0 ttpp -48.96 -41.5 34.32 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.196 0.998 . . . . 0.0 112.225 172.858 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.427 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 21.8 ptt180 -59.0 -37.62 77.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.826 0.45 . . . . 0.0 111.924 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 23.8 tp10 -66.79 -50.15 63.58 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 123.727 0.811 . . . . 0.0 110.029 175.727 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.459 HD11 ' HA ' ' A' ' 41' ' ' VAL . 76.7 mt -57.22 -50.08 74.0 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.157 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -52.07 -51.54 56.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.465 1.103 . . . . 0.0 111.504 -176.938 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -66.86 -37.06 83.73 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 124.127 0.892 . . . . 0.0 111.524 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.696 HG12 ' SD ' ' A' ' 58' ' ' MET . 95.7 t -66.38 -47.52 83.76 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 39.3 mt -57.72 -37.77 74.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.223 1.409 . . . . 0.0 112.888 177.997 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -68.54 -28.64 67.16 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 122.903 0.481 . . . . 0.0 111.413 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -71.54 -53.55 13.44 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 171.358 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.696 ' SD ' HG12 ' A' ' 54' ' ' VAL . 77.9 mtp -61.01 -32.38 71.98 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.971 1.308 . . . . 0.0 113.051 -172.83 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -70.44 -34.16 72.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.366 0.266 . . . . 0.0 111.162 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -71.54 -24.56 61.97 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.377 0.671 . . . . 0.0 110.326 173.085 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.07 5.8 42.79 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.368 1.067 . . . . 0.0 110.718 174.261 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 60.7 14.93 5.39 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.341 1.456 . . . . 0.0 112.775 177.384 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.493 ' HB3' HD23 ' A' ' 25' ' ' LEU . 96.3 mttt -73.97 -40.9 62.68 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.214 1.006 . . . . 0.0 110.838 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.462 HG11 ' HE1' ' A' ' 58' ' ' MET . 33.1 m -126.45 158.35 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.492 0.717 . . . . 0.0 110.517 179.109 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.1 m -135.63 150.27 49.58 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.627 1.171 . . . . 0.0 108.323 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.1 tp -99.96 110.77 23.09 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.5 p -82.54 -46.39 13.44 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 -177.43 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.447 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.4 m -133.21 163.65 49.59 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.311 -1.328 . . . . 0.0 108.18 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 19.3 Cg_exo -25.52 -63.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.393 2.901 1 C-N-CA 125.464 4.109 . . . . 0.0 116.432 -174.913 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.58 53.59 1.74 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.613 0.765 . . . . 0.0 110.508 172.904 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.541 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 36.0 m -132.39 120.53 22.15 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 172.379 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -106.21 169.17 8.66 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.449 1.1 . . . . 0.0 109.273 -174.666 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.2 t -151.16 159.96 44.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.656 0.782 . . . . 0.0 109.633 -175.726 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.62 HD23 ' HB2' ' A' ' 78' ' ' ASP . 35.7 tp -72.89 104.3 4.0 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 174.634 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -75.41 -25.84 67.19 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.64 177.623 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -76.12 161.79 52.21 Favored Glycine 0 C--N 1.349 1.27 0 O-C-N 123.94 0.435 . . . . 0.0 112.911 176.133 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.8 t -95.68 34.15 1.54 Allowed 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.594 0.758 . . . . 0.0 109.803 178.015 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . 0.62 ' HB2' HD23 ' A' ' 74' ' ' LEU . 11.7 m-20 -63.28 119.92 57.28 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 123.88 0.872 . . . . 0.0 111.939 -174.511 . . . . . . . . 2 2 . 1 . 010 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -83.47 -162.95 0.18 Allowed 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 123.367 2.711 . . . . 0.0 111.629 174.649 . . . . . . . . 1 1 . 1 . 010 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 . . . . . 0 CA--C 1.555 1.16 0 C-N-CA 123.573 0.749 . . . . 0.0 109.626 175.143 . . . . . . . . 0 0 . 1 . 011 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.432 ' SD ' ' N ' ' A' ' 1' ' ' MET . 1.4 mpt? . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 165.16 160.3 12.39 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 84.6 t60 59.21 88.93 0.06 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.715 1.206 . . . . 0.0 110.342 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -104.77 165.5 11.02 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.392 0.677 . . . . 0.0 109.47 -177.696 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.7 p80 -125.32 39.45 3.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.302 0.641 . . . . 0.0 110.67 -177.927 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.1 p80 -63.25 -18.41 63.52 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 122.702 0.401 . . . . 0.0 111.976 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -62.42 139.58 58.56 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.452 0.701 . . . . 0.0 110.341 169.387 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -71.76 -39.96 69.65 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.189 0.996 . . . . 0.0 111.604 -174.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.7 p -77.73 138.89 39.28 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.446 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 12.8 t60 -73.47 89.1 1.64 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 11' ' ' MET . . . . . 0.498 ' SD ' ' N ' ' A' ' 12' ' ' ALA . 1.2 tmt? -76.09 159.6 30.59 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 169.045 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . 0.498 ' N ' ' SD ' ' A' ' 11' ' ' MET . . . 68.6 177.44 0.26 Allowed 'General case' 0 C--O 1.249 1.029 0 C-N-CA 123.961 0.904 . . . . 0.0 110.285 -174.374 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 51.78 69.67 2.36 Favored Pre-proline 0 N--CA 1.477 0.922 0 C-N-CA 123.601 0.76 . . . . 0.0 109.278 -166.432 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -71.86 -172.71 0.87 Allowed 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 122.533 2.155 . . . . 0.0 112.59 -169.716 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -79.29 -179.5 52.11 Favored Glycine 0 C--O 1.252 1.252 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 168.171 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.427 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 38.5 ptt180 -58.61 -38.39 77.9 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 116.925 0.362 . . . . 0.0 111.842 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -64.4 -50.73 66.47 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 123.751 0.821 . . . . 0.0 110.237 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -54.42 -41.0 70.89 Favored Glycine 0 C--N 1.351 1.403 0 O-C-N 123.81 0.694 . . . . 0.0 114.37 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -75.76 -40.02 56.07 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.445 0.298 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.428 HD11 ' HA ' ' A' ' 51' ' ' LEU . 1.5 tm? -60.0 -52.8 63.86 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.817 1.247 . . . . 0.0 110.098 -178.911 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.756 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.8 tt0 -62.19 -44.66 96.1 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.995 1.318 . . . . 0.0 110.513 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -56.91 -44.98 82.93 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.37 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.446 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 0.8 OUTLIER -66.27 -47.7 72.82 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.312 0.645 . . . . 0.0 112.33 -178.793 . . . . . . . . 3 3 . 1 . 011 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.8 mt -60.74 -50.99 78.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 123.589 0.556 . . . . 0.0 110.126 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -64.2 -38.36 90.77 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 111.806 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -71.47 -40.12 70.49 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.747 0.654 . . . . 0.0 110.456 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.4 t -61.89 -39.16 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.144 0.578 . . . . 0.0 110.032 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.42 -29.03 63.34 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.564 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 29' ' ' THR . . . . . 0.487 ' HA ' HD22 ' A' ' 74' ' ' LEU . 86.4 m -75.49 -44.15 45.42 Favored 'General case' 0 C--N 1.353 0.755 0 C-N-CA 123.584 0.754 . . . . 0.0 111.395 176.79 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -70.11 -37.25 75.3 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.498 0.719 . . . . 0.0 110.229 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.33 -39.82 71.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 122.959 0.504 . . . . 0.0 109.7 172.711 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.53 31.5 67.01 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.751 -175.633 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -160.45 149.47 13.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.946 0.899 . . . . 0.0 109.091 -166.671 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -60.77 113.4 1.69 Allowed 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.976 2.451 . . . . 0.0 112.712 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.3 t -102.61 138.61 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.662 1.185 . . . . 0.0 108.208 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.87 149.48 50.53 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.347 0.659 . . . . 0.0 110.588 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.457 ' O ' HG23 ' A' ' 41' ' ' VAL . 25.3 tp -59.37 -49.08 79.19 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.555 1.159 . . . . 0.0 110.953 178.573 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.75 -36.98 17.63 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.107 0.963 . . . . 0.0 113.117 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.522 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 51.2 tt0 -76.66 -34.48 58.25 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.766 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.45 -29.24 69.89 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.288 0.635 . . . . 0.0 110.497 177.417 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.501 ' HA ' HD11 ' A' ' 51' ' ' LEU . 93.9 t -59.8 -53.09 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.839 0.855 . . . . 0.0 111.155 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.439 ' HE2' ' HG3' ' A' ' 39' ' ' GLN . 63.5 pttt -73.41 -34.73 65.64 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 123.648 0.592 . . . . 0.0 111.487 -177.767 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.522 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 26.9 mm-40 -62.04 -55.86 24.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.63 0.372 . . . . 0.0 110.616 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 45.4 t -81.83 -10.82 59.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.674 0.39 . . . . 0.0 110.714 -174.309 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 56.32 32.62 20.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.787 1.235 . . . . 0.0 110.886 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.61 149.72 53.48 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.176 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -61.11 130.93 34.37 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.599 2.199 . . . . 0.0 111.609 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -44.53 -36.29 2.91 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.387 1.475 . . . . 0.0 112.924 172.618 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.264 1.025 . . . . 0.0 111.544 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.08 -39.52 75.56 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.229 0.612 . . . . 0.0 111.061 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.501 HD11 ' HA ' ' A' ' 41' ' ' VAL . 93.9 mt -56.66 -52.46 64.82 Favored 'General case' 0 C--N 1.359 1.005 0 O-C-N 123.938 0.774 . . . . 0.0 110.67 175.358 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.8 m-20 -50.54 -51.39 48.27 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 125.137 1.375 . . . . 0.0 111.886 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -50.89 -52.83 37.94 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.336 1.054 . . . . 0.0 112.032 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.39 -37.86 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.471 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.412 HD11 ' NE1' ' A' ' 72' ' ' TRP . 38.8 mt -57.39 -46.02 83.88 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.863 1.265 . . . . 0.0 114.115 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -71.08 -28.76 64.57 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 119.271 0.941 . . . . 0.0 110.908 -178.821 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.433 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.5 tpp85 -66.73 -50.21 63.51 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.164 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.756 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 76.0 mtm -66.68 -27.53 67.73 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 124.109 0.963 . . . . 0.0 112.138 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -67.11 -40.37 86.87 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.583 0.753 . . . . 0.0 109.891 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -71.44 -34.54 70.37 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.873 0.733 . . . . 0.0 110.747 173.263 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.433 ' HG3' ' O ' ' A' ' 57' ' ' ARG . 51.0 mt-10 -76.69 -5.17 46.87 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.154 0.582 . . . . 0.0 111.197 174.966 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.8 mt 66.04 14.03 9.4 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.783 1.633 . . . . 0.0 112.492 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.537 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.2 mttt -69.65 -35.31 75.06 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 124.374 1.07 . . . . 0.0 110.611 175.218 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.2 m -126.69 152.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 O-C-N 123.907 0.754 . . . . 0.0 109.479 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 45.1 t -119.86 147.39 44.75 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.14 0.976 . . . . 0.0 108.826 176.093 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.6 tp -99.38 101.67 13.02 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.1 p -87.69 -34.15 18.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.677 0.791 . . . . 0.0 111.456 -175.097 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.47 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.7 m -139.42 161.16 58.62 Favored Pre-proline 0 N--CA 1.482 1.142 0 CA-C-O 117.21 -1.376 . . . . 0.0 107.57 176.301 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -25.53 -59.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 125.261 3.974 . . . . 0.0 116.606 -176.175 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -128.83 53.4 1.86 Allowed 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.456 0.646 . . . . 0.0 110.586 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.47 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 70.1 m -130.97 127.88 39.29 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.758 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.412 ' NE1' HD11 ' A' ' 55' ' ' LEU . 81.6 m95 -118.38 137.55 53.04 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.421 0.688 . . . . 0.0 110.468 -171.487 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 49.9 t -116.19 164.3 14.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.949 0.899 . . . . 0.0 109.518 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.487 HD22 ' HA ' ' A' ' 29' ' ' THR . 40.9 tp -67.64 108.56 2.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 173.962 . . . . . . . . 2 2 . 1 . 011 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.04 -25.47 72.11 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.782 0.676 . . . . 0.0 112.533 176.713 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.35 57.37 5.06 Favored Glycine 0 C--N 1.356 1.674 0 N-CA-C 111.891 -0.483 . . . . 0.0 111.891 172.596 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.1 t -89.78 -155.73 0.38 Allowed 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 125.294 1.438 . . . . 0.0 109.75 -175.32 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -53.81 133.77 56.69 Favored Pre-proline 0 N--CA 1.486 1.363 0 C-N-CA 123.939 0.895 . . . . 0.0 110.78 175.869 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -54.02 138.1 69.97 Favored 'Trans proline' 0 C--N 1.387 2.563 0 C-N-CA 123.325 2.683 . . . . 0.0 112.457 -177.968 . . . . . . . . 1 1 . 1 . 011 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 N--CA 1.479 1.016 0 C-N-CA 125.125 1.37 . . . . 0.0 110.668 -174.214 . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.3 mtt . . . . . 0 N--CA 1.486 1.352 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 012 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.11 -12.75 78.73 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 116.02 -0.536 . . . . 0.0 113.273 177.635 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.0 t60 65.24 9.55 5.71 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.431 1.093 . . . . 0.0 112.688 175.715 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 66.79 -71.39 0.1 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.949 1.3 . . . . 0.0 109.542 -167.998 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -84.79 130.78 34.63 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.847 0.859 . . . . 0.0 109.045 174.733 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.1 m-70 -82.54 -14.12 55.46 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.073 0.549 . . . . 0.0 112.034 -174.729 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -96.07 114.14 25.81 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 175.109 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -64.93 -29.08 70.0 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.875 0.87 . . . . 0.0 110.883 177.483 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.6 p -56.8 118.78 5.25 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.219 1.008 . . . . 0.0 110.817 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -68.54 -17.53 64.17 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 123.952 0.901 . . . . 0.0 111.516 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 12.6 tpt 67.62 90.38 0.1 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.743 1.217 . . . . 0.0 108.921 -171.897 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.55 104.11 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.765 1.226 . . . . 0.0 111.156 -177.181 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -146.95 97.98 4.13 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 123.608 0.763 . . . . 0.0 110.754 -176.654 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -88.99 12.69 2.67 Favored 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.258 2.638 . . . . 0.0 111.257 159.135 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.37 -84.05 0.1 Allowed Glycine 0 C--N 1.347 1.153 0 CA-C-N 114.131 -1.395 . . . . 0.0 112.5 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -57.32 -50.52 72.68 Favored 'General case' 0 C--O 1.21 -1.017 0 C-N-CA 123.345 0.658 . . . . 0.0 110.917 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.22 -37.88 88.67 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 124.016 0.822 . . . . 0.0 110.693 -173.17 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.15 -48.84 76.39 Favored Glycine 0 C--N 1.353 1.523 0 O-C-N 123.527 0.517 . . . . 0.0 114.275 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -64.98 -40.5 95.07 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.309 0.576 . . . . 0.0 110.028 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.407 HD12 HG21 ' A' ' 54' ' ' VAL . 2.9 tm? -62.0 -42.72 99.46 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.436 1.495 . . . . 0.0 110.215 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.499 ' HG3' ' HE1' ' A' ' 58' ' ' MET . 38.3 tt0 -64.05 -40.0 95.32 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.334 1.054 . . . . 0.0 110.398 177.64 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.71 -43.16 97.41 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.532 177.91 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.421 ' O ' HG22 ' A' ' 27' ' ' VAL . 42.8 mmm-85 -66.26 -45.4 80.69 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.564 0.746 . . . . 0.0 111.394 -177.458 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.505 HG22 HD22 ' A' ' 55' ' ' LEU . 75.5 mt -57.07 -45.41 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 123.952 0.782 . . . . 0.0 109.689 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.592 HD23 ' HB3' ' A' ' 63' ' ' LYS . 66.5 mt -65.0 -38.06 89.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.607 0.567 . . . . 0.0 111.169 -179.265 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.478 HE21 ' HG3' ' A' ' 30' ' ' GLU . 22.7 tp60 -69.42 -44.24 71.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.895 0.747 . . . . 0.0 109.983 -174.838 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.421 HG22 ' O ' ' A' ' 23' ' ' ARG . 98.5 t -58.85 -46.13 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.306 1.043 . . . . 0.0 110.793 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.39 -34.11 77.23 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.328 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -76.56 -45.28 31.22 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.815 0.446 . . . . 0.0 110.714 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.478 ' HG3' HE21 ' A' ' 26' ' ' GLN . 46.0 mt-10 -68.53 -42.12 78.91 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.923 0.489 . . . . 0.0 110.628 -175.948 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.18 -42.06 76.49 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.236 0.96 . . . . 0.0 111.758 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.75 28.06 71.03 Favored Glycine 0 C--N 1.35 1.346 0 O-C-N 123.61 0.568 . . . . 0.0 112.311 -176.03 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.7 p -161.38 154.56 17.8 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.541 1.137 . . . . 0.0 108.693 -172.88 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.43 ' HB3' HG23 ' A' ' 67' ' ' THR . 29.4 Cg_endo -60.86 124.35 14.78 Favored 'Trans proline' 0 C--N 1.374 1.916 0 C-N-CA 122.721 2.281 . . . . 0.0 112.426 178.011 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 72.8 t -105.41 128.06 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.483 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.9 mttt -68.29 150.6 48.05 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.422 ' O ' HG23 ' A' ' 41' ' ' VAL . 40.2 tp -56.94 -40.11 75.78 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.44 0.696 . . . . 0.0 110.071 174.434 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.09 -52.83 6.89 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.879 1.272 . . . . 0.0 112.227 167.001 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.461 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 10.2 tt0 -75.39 -25.32 57.53 Favored 'General case' 0 C--O 1.207 -1.167 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.573 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.25 -35.16 80.17 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.73 0.696 . . . . 0.0 110.525 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 37' ' ' LEU . 59.9 t -60.0 -43.03 91.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 C-N-CA 123.499 0.72 . . . . 0.0 110.082 172.399 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -66.82 -57.46 6.99 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.387 1.075 . . . . 0.0 111.017 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.461 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -65.37 -53.57 41.5 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.551 1.14 . . . . 0.0 112.415 -174.094 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.2 t -81.36 -12.8 58.89 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 122.732 0.413 . . . . 0.0 110.916 -175.204 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 67.19 13.39 9.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.3 1.44 . . . . 0.0 112.443 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -97.07 153.93 38.34 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 124.275 1.03 . . . . 0.0 111.086 -173.856 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.63 135.82 47.1 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.998 2.465 . . . . 0.0 112.285 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.509 ' HB2' ' HZ3' ' A' ' 48' ' ' LYS . 4.9 ttmp? -44.51 -46.09 9.62 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.573 1.149 . . . . 0.0 113.296 174.936 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -60.71 -39.97 90.52 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.208 0.603 . . . . 0.0 112.134 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -66.47 -50.81 62.08 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.294 0.371 . . . . 0.0 110.521 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 36.6 mt -57.38 -57.22 13.6 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 124.168 0.918 . . . . 0.0 110.395 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.418 ' HA ' HD12 ' A' ' 55' ' ' LEU . 27.8 t-20 -51.03 -52.16 45.87 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.24 1.416 . . . . 0.0 112.097 -177.547 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -57.79 -46.53 84.48 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.188 0.595 . . . . 0.0 111.852 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.407 HG21 HD12 ' A' ' 20' ' ' LEU . 90.7 t -63.72 -37.55 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 O-C-N 123.297 0.373 . . . . 0.0 110.141 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.505 HD22 HG22 ' A' ' 24' ' ' ILE . 30.3 mt -58.18 -30.67 66.59 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.488 1.115 . . . . 0.0 113.147 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . 0.491 ' HA ' ' HG2' ' A' ' 59' ' ' LYS . 18.7 m-85 -75.84 -25.42 56.23 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-N 119.348 0.976 . . . . 0.0 111.808 176.156 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.464 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.1 tmt_? -70.11 -50.91 36.01 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 171.107 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.499 ' HE1' ' HG3' ' A' ' 21' ' ' GLU . 85.2 mtp -61.69 -38.82 89.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.783 1.233 . . . . 0.0 112.345 -175.335 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . 0.491 ' HG2' ' HA ' ' A' ' 56' ' ' TYR . 17.5 ptpt -65.56 -37.18 85.96 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 120.785 0.326 . . . . 0.0 111.185 -176.937 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -68.44 -30.67 69.6 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.572 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.464 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 11.7 mm-40 -80.82 0.46 34.84 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.269 0.627 . . . . 0.0 111.237 176.113 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 68.23 17.44 9.33 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 125.053 1.341 . . . . 0.0 111.714 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.592 ' HB3' HD23 ' A' ' 25' ' ' LEU . 99.4 mttt -77.66 -37.02 50.78 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.347 0.659 . . . . 0.0 111.702 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.447 HG11 ' HE2' ' A' ' 58' ' ' MET . 35.3 m -127.72 146.94 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 CA-C-O 121.719 0.771 . . . . 0.0 111.303 178.8 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.7 m -109.29 134.05 52.28 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.968 1.307 . . . . 0.0 109.721 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -96.85 102.37 14.14 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 67' ' ' THR . . . . . 0.43 HG23 ' HB3' ' A' ' 34' ' ' PRO . 9.3 t -92.91 -32.94 14.4 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.257 -171.53 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.765 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.7 m -139.99 158.0 68.2 Favored Pre-proline 0 N--CA 1.478 0.96 0 CA-C-O 117.23 -1.367 . . . . 0.0 108.101 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -25.57 -70.12 0.04 OUTLIER 'Trans proline' 0 C--N 1.393 2.887 1 C-N-CA 125.589 4.193 . . . . 0.0 116.323 -175.025 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.41 17.19 20.37 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.792 0.837 . . . . 0.0 112.275 176.527 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.765 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 42.2 m -109.22 128.98 55.49 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 121.345 0.593 . . . . 0.0 110.439 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.424 ' CE2' HD11 ' A' ' 55' ' ' LEU . 73.9 m95 -112.31 168.19 9.82 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.485 1.114 . . . . 0.0 109.235 -175.242 . . . . . . . . 2 2 . 1 . 012 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 44.6 t -151.36 166.16 31.85 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.673 1.189 . . . . 0.0 108.391 178.134 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 42.6 tp -64.29 133.75 53.34 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.59 79.08 0.34 Allowed Glycine 0 C--N 1.348 1.223 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 172.435 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 132.63 45.38 0.13 Allowed Glycine 0 C--N 1.332 0.343 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 -167.834 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.7 t -60.72 -29.94 69.66 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.284 1.034 . . . . 0.0 111.652 -176.866 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -60.35 117.91 28.7 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.058 0.943 . . . . 0.0 110.734 177.778 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.62 99.17 0.61 Allowed 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.528 2.152 . . . . 0.0 110.278 175.195 . . . . . . . . 1 1 . 1 . 012 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.345 -169.948 . . . . . . . . 0 0 . 1 . 013 nuclear orig full ' A' A ' 1' ' ' MET . . . . . 0.457 ' HB3' ' HB3' ' A' ' 5' ' ' HIS . 25.7 mmt . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 . . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . 0.405 ' O ' ' HB3' ' A' ' 7' ' ' HIS . . . -105.38 -83.56 1.67 Allowed Glycine 0 C--N 1.347 1.164 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -69.04 -43.7 74.18 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.183 0.593 . . . . 0.0 109.883 179.367 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 -85.01 131.97 34.4 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.214 171.443 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . 0.457 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 50.6 t60 69.57 151.4 0.09 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.56 1.144 . . . . 0.0 111.364 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -45.05 102.77 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.897 1.279 . . . . 0.0 111.999 178.862 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . 0.405 ' HB3' ' O ' ' A' ' 2' ' ' GLY . 29.3 p80 -65.74 150.11 49.04 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.413 177.388 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -146.89 -60.42 0.29 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.634 0.374 . . . . 0.0 111.68 -176.498 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.3 t 58.57 -160.55 0.26 Allowed 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.701 0.801 . . . . 0.0 110.745 -175.03 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -127.78 -69.58 0.73 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.493 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 49.6 ttp -170.69 -28.88 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.209 0.604 . . . . 0.0 111.501 -177.09 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.94 111.4 0.55 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.414 1.086 . . . . 0.0 112.178 -170.789 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.76 136.81 96.88 Favored Pre-proline 0 N--CA 1.477 0.918 0 C-N-CA 124.561 1.145 . . . . 0.0 111.288 -171.306 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.2 77.11 1.64 Allowed 'Trans proline' 0 C--N 1.382 2.302 0 C-N-CA 123.098 2.532 . . . . 0.0 111.576 177.414 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -173.46 155.24 21.93 Favored Glycine 0 C--O 1.249 1.036 0 N-CA-C 107.931 -2.068 . . . . 0.0 107.931 -175.622 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . 0.41 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 34.2 ptt180 -59.39 -35.93 74.85 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -172.535 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . 0.43 ' HG3' HG23 ' A' ' 54' ' ' VAL . 44.8 tt0 -68.85 -57.01 6.16 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.042 0.937 . . . . 0.0 112.619 -173.608 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.454 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -55.63 -38.16 70.66 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.242 0.339 . . . . 0.0 113.797 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.2 m170 -73.6 -36.56 65.53 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.02 0.528 . . . . 0.0 110.648 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.495 HD11 HD23 ' A' ' 51' ' ' LEU . 2.4 tm? -62.52 -45.39 93.2 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.202 1.001 . . . . 0.0 109.905 177.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.424 ' HG3' ' HE1' ' A' ' 58' ' ' MET . 37.2 tt0 -58.34 -44.78 88.89 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.498 1.119 . . . . 0.0 110.444 176.444 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.454 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 15.9 mm100 -60.02 -39.79 87.08 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 124.059 0.849 . . . . 0.0 111.953 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.4 ' O ' HG23 ' A' ' 27' ' ' VAL . 23.0 tpt180 -68.37 -41.71 80.22 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-O 119.64 -0.219 . . . . 0.0 110.691 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.5 mt -61.51 -47.69 92.22 Favored 'Isoleucine or valine' 0 C--N 1.358 0.956 0 O-C-N 123.316 0.385 . . . . 0.0 110.202 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.492 HD23 ' HB3' ' A' ' 63' ' ' LYS . 95.8 mt -52.69 -44.06 66.01 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.749 0.82 . . . . 0.0 111.923 174.654 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.15 -54.7 25.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.78 0.675 . . . . 0.0 110.768 -177.527 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 23' ' ' ARG . 90.5 t -56.25 -45.86 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.187 0.995 . . . . 0.0 111.434 -177.056 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.59 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.9 mt -64.79 -35.84 82.4 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 123.637 0.586 . . . . 0.0 111.536 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -66.45 -46.18 77.32 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.874 0.469 . . . . 0.0 111.043 176.355 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.53 -40.33 80.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.153 0.581 . . . . 0.0 111.184 -174.229 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.55 87.84 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.006 0.523 . . . . 0.0 110.318 172.318 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.12 37.55 94.13 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.084 -177.587 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.1 t -164.6 152.09 10.21 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.501 0.72 . . . . 0.0 109.682 -167.488 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -50.26 126.53 17.66 Favored 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 123.14 2.56 . . . . 0.0 113.177 168.336 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 69.0 t -118.22 128.87 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.364 1.066 . . . . 0.0 108.31 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.557 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 56.4 mtmt -65.11 150.63 47.81 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 123.366 0.416 . . . . 0.0 110.401 176.152 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 41' ' ' VAL . 22.6 tp -61.94 -46.94 87.14 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.648 0.593 . . . . 0.0 110.761 176.46 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.68 -31.54 26.22 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.3 tt0 -80.24 -37.0 33.9 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.668 0.387 . . . . 0.0 110.292 174.436 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.03 -31.85 69.2 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.619 0.767 . . . . 0.0 110.774 178.656 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.493 ' HA ' HD13 ' A' ' 51' ' ' LEU . 25.0 t -54.72 -54.2 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 123.512 0.507 . . . . 0.0 111.493 176.807 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -74.6 -44.66 49.65 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.452 0.47 . . . . 0.0 111.965 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 34.0 mm-40 -59.26 -54.87 41.93 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.3 t -75.21 -16.53 60.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.233 0.613 . . . . 0.0 111.105 -178.711 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 65.21 23.17 12.24 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.2 1.4 . . . . 0.0 112.253 177.795 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.17 151.01 45.3 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.115 0.966 . . . . 0.0 109.831 -178.485 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.606 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 19.9 Cg_endo -59.75 136.59 71.43 Favored 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 122.681 2.254 . . . . 0.0 111.921 174.61 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -47.95 -33.24 7.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.991 1.316 . . . . 0.0 113.285 176.15 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.606 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 14.2 ptp180 -59.78 -46.31 89.57 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.177 0.591 . . . . 0.0 111.037 177.218 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.477 ' HG3' ' HG ' ' A' ' 20' ' ' LEU . 10.3 tp10 -67.09 -49.96 63.22 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.98 0.912 . . . . 0.0 110.521 -178.993 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.495 HD23 HD11 ' A' ' 20' ' ' LEU . 48.2 mt -56.45 -54.07 50.01 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.93 -179.362 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -51.29 -49.51 61.12 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.084 1.353 . . . . 0.0 112.171 -176.745 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.352 0.709 0 O-C-N 123.88 0.738 . . . . 0.0 111.821 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.43 HG23 ' HG3' ' A' ' 17' ' ' GLU . 78.1 t -68.82 -36.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 122.545 0.338 . . . . 0.0 110.785 -176.876 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.4 mt -52.68 -37.88 59.56 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.319 1.048 . . . . 0.0 112.917 173.078 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -70.16 -31.48 68.99 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.642 0.655 . . . . 0.0 111.513 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -64.1 -52.43 59.25 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.427 ' HE2' HG11 ' A' ' 64' ' ' VAL . 74.9 mtp -62.02 -33.44 74.37 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 124.152 0.981 . . . . 0.0 111.336 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -62.42 -42.31 99.35 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.574 0.749 . . . . 0.0 111.908 175.233 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -69.52 -22.56 63.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.267 0.627 . . . . 0.0 111.273 173.533 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 18.6 mm-40 -89.1 -0.28 57.31 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.446 0.698 . . . . 0.0 111.309 173.079 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 65.48 11.17 7.19 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 125.027 1.331 . . . . 0.0 112.43 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.492 ' HB3' HD23 ' A' ' 25' ' ' LEU . 96.7 mttt -74.53 -34.82 63.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.869 0.868 . . . . 0.0 111.2 -178.836 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.427 HG11 ' HE2' ' A' ' 58' ' ' MET . 24.4 m -128.9 147.07 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.229 0.612 . . . . 0.0 109.637 175.49 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 65' ' ' SER . . . . . 0.62 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 49.0 m -121.0 156.28 32.48 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.962 0.905 . . . . 0.0 109.459 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.7 tp -104.17 103.31 13.07 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.7 t -95.68 -36.4 11.22 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.366 0.666 . . . . 0.0 111.127 -169.143 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.57 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.1 m -139.34 166.8 21.89 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 123.584 0.754 . . . . 0.0 109.469 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -51.06 106.92 0.15 Allowed 'Trans proline' 0 C--N 1.39 2.731 0 C-N-CA 123.177 2.585 . . . . 0.0 113.195 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 66.11 21.31 11.19 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.569 1.148 . . . . 0.0 111.933 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.57 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 29.2 m -120.14 122.75 41.71 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 123.937 0.895 . . . . 0.0 108.771 -177.849 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -106.99 169.01 8.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.62 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 24.6 p -150.74 158.49 44.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.575 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.59 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 18.7 tp -78.26 105.07 9.25 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.07 -58.58 10.34 Favored Glycine 0 C--N 1.345 1.033 0 O-C-N 123.843 0.715 . . . . 0.0 111.327 176.774 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.18 79.03 1.95 Allowed Glycine 0 C--N 1.34 0.756 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 171.842 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 7.7 m -69.87 85.64 0.5 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.742 0.817 . . . . 0.0 111.579 -173.354 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.5 t70 55.47 68.69 2.31 Favored Pre-proline 0 CA--C 1.557 1.219 0 C-N-CA 124.892 1.277 . . . . 0.0 110.879 177.256 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -73.54 94.85 0.85 Allowed 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 122.752 2.301 . . . . 0.0 113.968 -168.265 . . . . . . . . 1 1 . 1 . 013 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 . . . . . 0 CA--C 1.557 1.229 0 CA-C-O 118.542 -0.742 . . . . 0.0 110.389 175.445 . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.7 mtt . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 . . . . . . . . . 0 0 . 1 . 014 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.15 19.79 2.3 Favored Glycine 0 C--N 1.353 1.473 0 CA-C-O 119.967 -0.351 . . . . 0.0 113.754 -174.648 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -123.84 111.88 16.62 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 172.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -104.33 -5.39 21.83 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -110.41 92.0 3.88 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 175.982 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -156.34 11.93 0.28 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.408 1.083 . . . . 0.0 109.222 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -57.05 -69.54 0.15 Allowed 'General case' 0 C--N 1.357 0.899 0 C-N-CA 123.698 0.799 . . . . 0.0 111.485 -168.729 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.2 m80 58.76 -75.86 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 125.015 1.326 . . . . 0.0 112.093 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.1 m -49.14 127.49 14.67 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.088 1.355 . . . . 0.0 112.574 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.5 m-70 -88.31 29.79 0.94 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.924 0.89 . . . . 0.0 111.836 -175.317 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 50.0 ttm -138.98 -58.84 0.6 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.672 0.789 . . . . 0.0 109.091 177.643 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.26 87.25 1.97 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.358 0.663 . . . . 0.0 110.692 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.6 135.67 43.17 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 123.763 0.825 . . . . 0.0 109.945 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -79.68 4.56 6.58 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 123.2 2.6 . . . . 0.0 113.302 -179.0 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -29.25 89.77 0.01 OUTLIER Glycine 0 C--N 1.356 1.658 0 O-C-N 125.285 1.615 . . . . 0.0 114.697 174.915 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.4 mtp-105 -54.4 -15.27 1.56 Allowed 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -168.41 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -56.11 -43.31 78.0 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -156.763 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -69.81 -40.27 75.47 Favored Glycine 0 C--N 1.35 1.33 0 N-CA-C 115.541 0.976 . . . . 0.0 115.541 177.253 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -72.89 -37.95 67.13 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.006 0.908 . . . . 0.0 110.149 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.571 HD13 HD23 ' A' ' 51' ' ' LEU . 3.0 tm? -66.15 -36.43 83.11 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 113.378 -1.737 . . . . 0.0 110.156 174.247 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.416 ' HG3' ' HG2' ' A' ' 58' ' ' MET . 34.6 tt0 -60.64 -46.16 91.35 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.316 1.046 . . . . 0.0 110.32 174.105 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 69.8 mt-30 -65.98 -32.62 74.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.438 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.492 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -66.74 -48.66 68.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.48 0.712 . . . . 0.0 109.353 176.949 . . . . . . . . 3 3 . 1 . 014 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.435 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.2 mt -57.65 -49.17 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 124.275 0.984 . . . . 0.0 109.878 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.49 HD23 ' HB3' ' A' ' 63' ' ' LYS . 78.2 mt -55.8 -40.15 72.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 123.596 0.758 . . . . 0.0 110.832 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -70.87 -41.48 71.31 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 123.865 0.728 . . . . 0.0 110.692 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.492 HG23 ' O ' ' A' ' 23' ' ' ARG . 60.5 t -54.69 -46.34 73.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.298 0.639 . . . . 0.0 110.221 174.692 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.435 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 71.2 mt -65.26 -39.76 93.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.253 -178.665 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -69.58 -48.48 60.04 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.279 1.032 . . . . 0.0 112.043 -177.472 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.99 -36.15 81.54 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.616 0.766 . . . . 0.0 110.237 -176.703 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.73 87.51 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.782 171.983 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 24.31 70.34 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.951 -171.272 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -153.35 149.56 21.75 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.413 1.085 . . . . 0.0 109.36 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -55.17 114.66 1.97 Allowed 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.533 2.156 . . . . 0.0 112.277 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . 0.43 HG23 HG11 ' A' ' 27' ' ' VAL . 91.7 t -96.04 131.5 42.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.777 0.831 . . . . 0.0 108.924 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 46.2 mtpt -73.12 151.27 41.66 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.04 0.536 . . . . 0.0 109.943 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.472 ' O ' HG23 ' A' ' 41' ' ' VAL . 36.2 tp -54.09 -44.74 71.47 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.394 1.058 . . . . 0.0 111.199 178.515 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.89 -49.18 11.11 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.043 0.937 . . . . 0.0 112.627 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.412 ' HA ' ' HG2' ' A' ' 42' ' ' LYS . 52.1 tt0 -77.07 -28.18 54.55 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.595 0.358 . . . . 0.0 110.807 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.14 -32.27 73.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.336 0.255 . . . . 0.0 110.358 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.535 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.2 t -59.68 -55.44 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.302 0.641 . . . . 0.0 110.786 175.137 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . 0.412 ' HG2' ' HA ' ' A' ' 39' ' ' GLN . 20.3 ptmt -69.9 -42.26 73.63 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.601 -174.018 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -72.47 -36.25 68.41 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.8 m -83.75 -17.04 42.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 117.866 0.303 . . . . 0.0 111.443 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 58.94 27.53 16.4 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.533 1.133 . . . . 0.0 111.82 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.68 154.9 54.98 Favored Pre-proline 0 C--O 1.245 0.854 0 C-N-CA 124.283 1.033 . . . . 0.0 109.963 -174.433 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.43 131.13 30.66 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.504 2.136 . . . . 0.0 111.864 177.916 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.523 ' HA ' HD13 ' A' ' 51' ' ' LEU . 40.5 ttmt -45.23 -41.05 8.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.486 1.515 . . . . 0.0 113.239 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -53.81 -49.4 68.45 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.816 0.846 . . . . 0.0 111.264 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.97 -44.25 96.56 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 123.467 0.707 . . . . 0.0 110.773 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.571 HD23 HD13 ' A' ' 20' ' ' LEU . 75.1 mt -54.73 -51.07 66.78 Favored 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.513 1.133 . . . . 0.0 110.671 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.38 -54.73 23.61 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.257 0.973 . . . . 0.0 112.311 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -53.57 -44.89 69.68 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.657 HG11 ' SD ' ' A' ' 58' ' ' MET . 94.8 t -66.37 -51.1 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 122.869 0.467 . . . . 0.0 110.789 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.429 HD11 ' NE1' ' A' ' 72' ' ' TRP . 57.7 mt -48.63 -49.62 36.39 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.509 1.524 . . . . 0.0 114.537 -176.744 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -69.35 -29.43 67.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.451 0.301 . . . . 0.0 111.421 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -67.57 -47.76 68.86 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 174.069 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.657 ' SD ' HG11 ' A' ' 54' ' ' VAL . 73.2 mtp -60.58 -34.06 73.62 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.908 0.883 . . . . 0.0 110.927 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -64.78 -42.62 94.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.748 0.819 . . . . 0.0 110.82 177.28 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -59.91 -44.05 94.51 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.74 0.816 . . . . 0.0 110.423 172.819 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -78.92 -1.28 34.5 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.469 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt 62.93 15.72 8.58 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 125.343 1.457 . . . . 0.0 112.28 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.49 ' HB3' HD23 ' A' ' 25' ' ' LEU . 92.4 mttt -67.96 -33.24 74.27 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.573 1.149 . . . . 0.0 109.868 173.463 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.492 HG11 ' HE2' ' A' ' 58' ' ' MET . 28.9 m -129.1 169.43 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.265 0.626 . . . . 0.0 109.451 173.498 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.9 t -134.05 147.32 50.91 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 176.638 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.4 tp -100.54 106.28 17.78 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 35.1 p -93.7 -34.29 13.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.636 0.774 . . . . 0.0 111.772 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.675 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 47.6 t -141.15 154.65 68.07 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -21.68 -67.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.394 2.957 1 C-N-CA 125.594 4.196 . . . . 0.0 116.513 -177.149 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.08 51.69 1.42 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.489 0.661 . . . . 0.0 110.538 173.218 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.675 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 69.3 m -131.87 128.57 38.9 Favored 'General case' 0 C--O 1.243 0.711 0 C-N-CA 123.647 0.779 . . . . 0.0 109.541 172.045 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . 0.429 ' NE1' HD11 ' A' ' 55' ' ' LEU . 75.2 m95 -117.67 142.22 47.49 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.789 0.836 . . . . 0.0 109.701 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 38.7 t -115.87 166.31 12.11 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.585 0.754 . . . . 0.0 109.848 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.83 129.6 40.39 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.708 0.803 . . . . 0.0 109.428 174.861 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.02 92.76 0.56 Allowed Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 175.821 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 86.68 178.89 49.24 Favored Glycine 0 C--N 1.345 1.057 0 N-CA-C 111.853 -0.499 . . . . 0.0 111.853 -175.039 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 44.7 m -78.52 -44.43 24.4 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 121.457 0.646 . . . . 0.0 109.763 178.829 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -133.32 137.03 28.26 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.131 -176.074 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.52 113.71 3.85 Favored 'Trans proline' 0 C--N 1.372 1.764 0 C-N-CA 122.352 2.035 . . . . 0.0 111.064 171.046 . . . . . . . . 1 1 . 1 . 014 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.249 0 CA-C-O 118.724 -0.655 . . . . 0.0 109.994 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.0 mtm . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 015 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.03 -27.05 65.13 Favored Glycine 0 C--N 1.355 1.588 0 CA-C-N 116.029 -0.532 . . . . 0.0 113.465 -176.617 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.3 m170 -76.35 -0.53 22.94 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.233 0.613 . . . . 0.0 112.127 177.389 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -67.83 141.66 56.4 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 m170 68.28 97.56 0.06 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.719 1.208 . . . . 0.0 109.236 -169.18 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.4 t60 -70.85 116.7 11.46 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.109 0.563 . . . . 0.0 110.754 -176.23 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -94.13 165.78 12.45 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.738 0.815 . . . . 0.0 109.759 170.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -153.7 160.91 42.49 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.11 0.564 . . . . 0.0 110.278 177.339 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.2 t -115.85 125.2 52.34 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.897 0.879 . . . . 0.0 108.951 179.313 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 68.1 t60 -65.23 -53.03 50.57 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.78 0.832 . . . . 0.0 110.635 -176.131 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.9 ptm -84.47 72.36 10.63 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 122.409 1.099 . . . . 0.0 109.726 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.48 21.56 0.15 Allowed 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.028 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 76.6 115.68 0.03 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 126.222 1.809 . . . . 0.0 110.226 -172.572 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.54 -36.94 61.66 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 123.591 2.86 . . . . 0.0 112.732 173.078 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -153.6 114.15 0.61 Allowed Glycine 0 C--N 1.337 0.609 0 N-CA-C 107.999 -2.04 . . . . 0.0 107.999 167.249 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -59.39 -34.36 72.34 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.709 0.804 . . . . 0.0 112.014 -169.156 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.47 -50.61 69.01 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.737 0.815 . . . . 0.0 109.67 -178.123 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -51.51 -38.22 42.44 Favored Glycine 0 C--N 1.346 1.117 0 O-C-N 123.77 0.669 . . . . 0.0 114.442 177.288 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -83.39 -32.62 26.07 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.393 0.277 . . . . 0.0 110.817 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.555 HD11 ' HA ' ' A' ' 51' ' ' LEU . 0.8 OUTLIER -60.35 -53.11 61.54 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.454 1.102 . . . . 0.0 108.937 178.433 . . . . . . . . 3 3 . 1 . 015 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.756 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.6 tt0 -59.48 -47.46 85.41 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.551 176.011 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -60.59 -41.18 94.17 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 123.784 0.678 . . . . 0.0 109.963 -173.463 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 0.5 OUTLIER -64.51 -49.62 70.62 Favored 'General case' 0 C--N 1.346 0.426 0 C-N-CA 123.666 0.787 . . . . 0.0 111.968 -178.941 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 76.1 mt -58.62 -49.52 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 124.056 0.848 . . . . 0.0 110.152 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.51 -38.76 91.18 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 123.586 0.754 . . . . 0.0 111.286 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -70.92 -41.41 71.25 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.47 0.481 . . . . 0.0 110.573 -176.693 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 86.7 t -63.31 -37.52 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.105 0.562 . . . . 0.0 110.338 176.68 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.51 HD22 ' HA ' ' A' ' 73' ' ' CYS . 89.5 mt -71.09 -28.94 64.7 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.767 0.427 . . . . 0.0 111.123 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 99.0 m -73.6 -49.58 25.49 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.048 0.939 . . . . 0.0 111.632 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -66.85 -32.08 73.11 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.158 0.583 . . . . 0.0 110.572 -176.2 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.32 -47.73 80.98 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.918 169.971 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.66 27.29 69.61 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.975 0.797 . . . . 0.0 111.332 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.4 t -160.5 151.13 15.29 Favored Pre-proline 0 C--O 1.245 0.86 0 C-N-CA 124.478 1.111 . . . . 0.0 109.238 -166.155 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -56.52 123.83 14.78 Favored 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 122.738 2.292 . . . . 0.0 112.209 172.575 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 88.0 t -113.62 137.21 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.475 1.11 . . . . 0.0 108.61 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.437 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 95.1 mttt -75.1 148.56 39.62 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 123.221 0.608 . . . . 0.0 109.456 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 41' ' ' VAL . 45.6 tp -54.01 -43.09 69.77 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 124.544 1.152 . . . . 0.0 111.013 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -43.2 -51.06 6.25 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.502 1.121 . . . . 0.0 113.184 170.57 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -74.42 -30.91 62.11 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.931 0.493 . . . . 0.0 110.84 -179.092 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.407 HD12 ' HA ' ' A' ' 37' ' ' LEU . 97.0 mt -61.83 -33.6 74.44 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.897 0.479 . . . . 0.0 110.192 175.895 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 37' ' ' LEU . 60.9 t -59.38 -55.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.609 0.764 . . . . 0.0 111.738 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -68.67 -41.98 78.52 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 123.853 0.721 . . . . 0.0 111.003 -174.007 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -67.81 -48.17 67.03 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.208 0.603 . . . . 0.0 112.03 -178.098 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 63.6 m -77.83 -13.67 59.81 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.004 0.521 . . . . 0.0 111.325 -177.421 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 57.69 40.57 26.39 Favored 'General case' 0 C--N 1.364 1.203 0 C-N-CA 124.253 1.021 . . . . 0.0 110.407 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.487 ' HB2' HD22 ' A' ' 51' ' ' LEU . . . -138.6 154.29 73.14 Favored Pre-proline 0 CA--C 1.553 1.075 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.599 -172.509 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -60.61 129.06 27.88 Favored 'Trans proline' 0 C--N 1.381 2.269 0 C-N-CA 123.198 2.598 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -41.0 -48.82 3.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.178 1.391 . . . . 0.0 114.08 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.452 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 82.1 mtm180 -59.24 -45.45 91.13 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 123.87 0.731 . . . . 0.0 111.061 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.06 -46.28 81.83 Favored 'General case' 0 C--O 1.241 0.622 0 O-C-N 123.957 0.786 . . . . 0.0 109.661 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.555 ' HA ' HD11 ' A' ' 20' ' ' LEU . 81.3 mt -56.1 -49.86 72.66 Favored 'General case' 0 C--N 1.356 0.874 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.927 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.405 ' HA ' HD13 ' A' ' 55' ' ' LEU . 22.2 t-20 -63.15 -43.4 98.42 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.385 1.053 . . . . 0.0 112.698 -173.997 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.452 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 78.8 mm-40 -60.97 -45.39 94.97 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 120.573 0.225 . . . . 0.0 111.058 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.5 t -66.17 -38.33 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.341 0.656 . . . . 0.0 110.705 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.405 HD13 ' HA ' ' A' ' 52' ' ' ASN . 14.7 mt -53.1 -39.64 63.54 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.684 1.193 . . . . 0.0 112.767 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -68.03 -35.31 78.06 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 118.417 0.553 . . . . 0.0 112.033 179.129 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.484 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 66.1 ttp85 -68.01 -50.34 56.07 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.756 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 69.6 mtm -62.27 -28.39 69.68 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.989 0.806 . . . . 0.0 111.678 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -71.84 -38.91 70.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -63.44 -39.91 95.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.304 0.642 . . . . 0.0 110.414 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.484 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.33 -2.54 45.8 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.759 0.824 . . . . 0.0 111.436 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.1 mt 68.59 10.33 7.82 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.155 1.382 . . . . 0.0 112.529 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.555 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 64.5 mttm -64.66 -32.02 73.5 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.875 0.87 . . . . 0.0 110.416 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 18.5 m -130.62 165.37 31.1 Favored 'Isoleucine or valine' 0 C--O 1.245 0.834 0 C-N-CA 124.106 0.962 . . . . 0.0 109.115 172.678 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 t -143.44 145.13 32.36 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.5 tp -95.7 103.88 15.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.151 0.58 . . . . 0.0 109.546 -172.741 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 33.5 p -84.16 -45.62 12.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.572 0.749 . . . . 0.0 112.082 -174.205 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.511 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 17.8 m -132.29 169.43 13.91 Favored Pre-proline 0 N--CA 1.479 0.999 0 CA-C-O 117.44 -1.267 . . . . 0.0 107.587 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.413 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 2.3 Cg_exo -29.09 -78.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 124.689 3.593 . . . . 0.0 115.266 178.529 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -100.18 19.52 16.31 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 118.89 0.768 . . . . 0.0 112.026 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.511 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 20.6 m -107.97 125.85 52.01 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.134 0.492 . . . . 0.0 109.859 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.16 168.35 10.19 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.51 ' HA ' HD22 ' A' ' 28' ' ' LEU . 35.4 t -149.06 164.41 34.72 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.885 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.54 ' HG ' ' H ' ' A' ' 76' ' ' GLY . 40.1 tp -65.98 143.82 57.14 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.529 0.518 . . . . 0.0 109.724 175.898 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.49 -18.4 71.69 Favored Glycine 0 C--N 1.344 0.993 0 O-C-N 123.649 0.593 . . . . 0.0 113.249 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . 0.54 ' H ' ' HG ' ' A' ' 74' ' ' LEU . . . -78.88 -10.4 86.22 Favored Glycine 0 C--N 1.344 1.008 0 CA-C-O 119.62 -0.545 . . . . 0.0 114.115 175.544 . . . . . . . . 2 2 . 1 . 015 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.6 m -80.11 83.18 6.03 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-O 121.258 0.551 . . . . 0.0 109.833 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.86 131.04 38.55 Favored Pre-proline 0 N--CA 1.476 0.844 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.469 179.367 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.22 118.25 4.63 Favored 'Trans proline' 0 C--N 1.369 1.609 0 C-N-CA 122.436 2.09 . . . . 0.0 110.558 171.426 . . . . . . . . 1 1 . 1 . 015 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 CA--C 1.549 0.941 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 175.23 . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 mtt . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 0 0 . 1 . 016 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.55 -97.89 0.72 Allowed Glycine 0 C--N 1.349 1.279 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.914 -175.315 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -97.72 -42.39 7.64 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 170.566 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -146.94 -73.62 0.21 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.863 0.865 . . . . 0.0 110.731 -176.831 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -115.03 -21.76 9.88 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.827 0.851 . . . . 0.0 112.633 -172.892 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -71.35 99.31 1.93 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.416 0.686 . . . . 0.0 111.036 -174.43 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.5 p-80 -110.57 -173.77 2.32 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.441 1.096 . . . . 0.0 111.887 -174.474 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.4 m170 -60.47 106.63 0.57 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.368 1.067 . . . . 0.0 110.213 173.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.9 t -129.12 88.62 2.74 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.088 0.555 . . . . 0.0 110.484 -175.242 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -137.84 32.68 2.44 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.795 0.838 . . . . 0.0 109.946 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.8 mmt 60.18 87.52 0.09 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 124.634 1.174 . . . . 0.0 108.753 -172.687 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 64.35 -159.61 0.3 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.293 1.037 . . . . 0.0 109.349 -163.106 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -148.93 102.79 3.38 Favored Pre-proline 0 N--CA 1.471 0.606 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -102.32 111.99 0.05 OUTLIER 'Trans proline' 0 CA--C 1.561 1.843 0 C-N-CA 123.665 2.91 . . . . 0.0 112.443 165.755 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.32 -45.05 0.44 Allowed Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.366 -0.693 . . . . 0.0 111.366 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.37 -33.18 67.04 Favored 'General case' 0 C--O 1.209 -1.041 0 CA-C-O 118.449 -0.786 . . . . 0.0 112.898 178.708 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -66.59 -56.62 9.92 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 -160.494 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . 0.443 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -66.3 -27.59 73.13 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-O 120.145 -0.253 . . . . 0.0 113.315 177.127 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -73.76 -35.15 64.97 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.637 0.775 . . . . 0.0 109.163 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.508 HD12 ' HA ' ' A' ' 51' ' ' LEU . 2.8 tm? -66.88 -39.36 87.46 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.784 1.634 . . . . 0.0 108.978 176.335 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -66.71 -38.44 86.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.965 0.906 . . . . 0.0 110.202 177.199 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . 0.443 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 56.0 mt-30 -62.69 -40.19 96.33 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.879 0.872 . . . . 0.0 110.455 174.228 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -68.52 -42.87 77.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 123.614 0.766 . . . . 0.0 111.599 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.443 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.1 mt -58.89 -52.3 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 123.827 0.705 . . . . 0.0 109.361 177.926 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.584 HD23 ' HB3' ' A' ' 63' ' ' LYS . 91.5 mt -58.27 -40.47 81.95 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.493 0.717 . . . . 0.0 111.367 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -67.48 -49.07 65.18 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.468 0.707 . . . . 0.0 111.092 -177.294 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.44 -39.49 79.29 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.534 1.134 . . . . 0.0 111.349 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 73' ' ' CYS . 85.7 mt -67.89 -40.02 83.58 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.875 0.87 . . . . 0.0 110.915 176.619 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -68.48 -48.83 63.46 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.999 0.919 . . . . 0.0 111.426 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -71.42 -39.51 71.03 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 123.182 0.593 . . . . 0.0 110.95 -173.469 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.6 -33.63 75.38 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.505 0.503 . . . . 0.0 111.059 173.585 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.36 32.52 84.47 Favored Glycine 0 C--N 1.354 1.542 0 O-C-N 123.959 0.787 . . . . 0.0 112.771 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 p -170.31 155.86 5.31 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 124.192 0.997 . . . . 0.0 109.141 -171.348 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.567 ' HB3' ' HB2' ' A' ' 73' ' ' CYS . 20.2 Cg_endo -60.92 118.26 5.11 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.728 2.285 . . . . 0.0 112.998 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.79 135.66 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -66.11 143.75 57.12 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.511 0.724 . . . . 0.0 109.986 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.474 HD13 HD13 ' A' ' 55' ' ' LEU . 13.1 tp -61.26 -41.77 97.49 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.912 0.885 . . . . 0.0 110.67 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.5 -41.91 10.13 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.094 0.957 . . . . 0.0 113.42 167.736 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.533 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 27.4 tt0 -82.89 -29.45 29.27 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.409 ' O ' ' SG ' ' A' ' 44' ' ' CYS . 78.1 mt -60.05 -34.63 73.67 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.683 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.409 HG23 ' O ' ' A' ' 37' ' ' LEU . 91.5 t -51.8 -56.32 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 124.708 1.203 . . . . 0.0 111.701 175.206 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -71.53 -37.51 71.17 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.181 -173.727 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.533 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 9.1 mm-40 -61.38 -53.11 60.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.03 0.532 . . . . 0.0 111.704 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.492 ' SG ' ' HB2' ' A' ' 46' ' ' ALA . 30.4 p -83.93 -10.32 58.05 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.113 0.565 . . . . 0.0 111.127 -176.33 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 63.67 17.59 10.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.623 1.169 . . . . 0.0 111.797 -178.87 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.492 ' HB2' ' SG ' ' A' ' 44' ' ' CYS . . . -107.98 151.84 41.45 Favored Pre-proline 0 N--CA 1.476 0.828 0 C-N-CA 124.134 0.974 . . . . 0.0 110.867 -175.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.3 140.24 81.82 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.548 2.165 . . . . 0.0 111.575 175.383 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -47.1 -34.32 5.88 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 124.19 0.996 . . . . 0.0 112.553 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . 0.431 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 20.4 tpp180 -61.82 -47.38 85.33 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.241 0.616 . . . . 0.0 111.779 177.303 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -62.66 -47.31 84.26 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 123.326 0.65 . . . . 0.0 110.249 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.508 ' HA ' HD12 ' A' ' 20' ' ' LEU . 17.3 mt -53.34 -56.46 16.53 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 124.62 1.168 . . . . 0.0 110.893 176.151 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -49.21 -52.53 26.31 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 126.091 1.757 . . . . 0.0 111.868 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . 0.431 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 14.3 mm100 -53.42 -47.99 69.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.945 0.898 . . . . 0.0 111.667 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.497 HG22 HD11 ' A' ' 20' ' ' LEU . 85.1 t -68.32 -44.89 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.25 -179.07 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.474 HD13 HD13 ' A' ' 37' ' ' LEU . 54.6 mt -52.32 -44.51 65.14 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.496 1.518 . . . . 0.0 114.306 -177.211 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -62.89 -32.45 73.71 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.202 0.456 . . . . 0.0 111.071 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.454 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.5 mmm-85 -70.68 -49.17 50.09 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 123.03 0.532 . . . . 0.0 109.768 177.352 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.47 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 70.7 mtp -57.77 -36.12 71.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.114 0.966 . . . . 0.0 111.618 -177.159 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -59.4 -44.04 92.87 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.427 0.691 . . . . 0.0 110.246 176.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -75.29 -25.33 57.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.502 1.121 . . . . 0.0 111.81 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.454 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 7.0 mm-40 -77.83 -4.65 47.63 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.041 0.536 . . . . 0.0 110.001 170.935 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . 0.521 ' HB3' ' HG3' ' A' ' 80' ' ' GLU . 83.1 mt 68.32 19.19 9.04 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 125.541 1.536 . . . . 0.0 111.438 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.584 ' HB3' HD23 ' A' ' 25' ' ' LEU . 98.8 mttt -80.72 -33.42 35.26 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.782 1.233 . . . . 0.0 111.711 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.9 m -132.74 161.75 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-O 121.267 0.556 . . . . 0.0 111.189 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.6 t -132.31 145.34 51.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.904 1.281 . . . . 0.0 108.61 174.1 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 47.0 tp -95.67 109.01 21.35 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 37.3 p -84.78 -44.57 13.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.161 0.584 . . . . 0.0 111.168 -175.46 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.665 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 13.1 m -134.72 159.5 71.93 Favored Pre-proline 0 CA--C 1.555 1.141 0 CA-C-O 117.212 -1.375 . . . . 0.0 107.64 -175.852 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -29.68 -66.02 0.07 OUTLIER 'Trans proline' 0 C--N 1.396 3.059 0 C-N-CA 125.017 3.811 . . . . 0.0 116.243 -174.547 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.65 40.07 3.02 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.924 0.889 . . . . 0.0 111.084 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.665 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 91.1 m -131.2 122.82 27.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.606 0.762 . . . . 0.0 109.869 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.5 m95 -114.25 151.47 32.79 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.119 0.968 . . . . 0.0 108.698 -172.829 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.567 ' HB2' ' HB3' ' A' ' 34' ' ' PRO . 42.7 t -132.54 170.26 15.41 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.053 0.941 . . . . 0.0 109.209 177.904 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.0 tp -68.49 160.31 30.06 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.423 ' HA3' ' HB3' ' A' ' 79' ' ' PRO . . . -57.27 -32.73 64.06 Favored Glycine 0 N--CA 1.476 1.313 0 C-N-CA 122.74 0.209 . . . . 0.0 112.722 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 146.23 -171.55 27.08 Favored Glycine 0 C--N 1.346 1.138 0 C-N-CA 123.228 0.442 . . . . 0.0 112.076 173.39 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.8 t -66.01 102.37 0.79 Allowed 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 170.927 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.9 t70 58.88 86.24 0.16 Allowed Pre-proline 0 N--CA 1.486 1.356 0 C-N-CA 124.294 1.038 . . . . 0.0 109.374 -166.148 . . . . . . . . 1 1 . 1 . 016 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . 0.423 ' HB3' ' HA3' ' A' ' 75' ' ' GLY . 37.8 Cg_exo -58.73 105.7 0.24 Allowed 'Trans proline' 0 C--N 1.385 2.478 0 C-N-CA 123.154 2.569 . . . . 0.0 113.248 -173.801 . . . . . . . . 2 2 . 1 . 016 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . 0.521 ' HG3' ' HB3' ' A' ' 62' ' ' LEU . 51.3 mm-40 . . . . . 0 CA--C 1.557 1.219 0 C-N-CA 125.051 1.34 . . . . 0.0 111.701 174.289 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptp . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 017 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.41 26.31 0.09 OUTLIER Glycine 0 C--N 1.354 1.532 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.156 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -131.18 60.53 1.66 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.052 0.941 . . . . 0.0 109.153 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -159.81 100.72 1.45 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 171.951 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -62.83 96.27 0.09 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 121.264 0.554 . . . . 0.0 110.408 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -113.53 -21.61 10.74 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.923 0.889 . . . . 0.0 110.209 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -74.72 -65.81 0.82 Allowed 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 172.93 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -93.73 97.09 10.21 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.8 0.81 . . . . 0.0 109.43 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.0 t -165.33 9.37 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.5 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 42.7 m80 -127.71 -176.14 3.68 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.274 1.03 . . . . 0.0 108.917 -174.707 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.7 150.79 41.0 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 122.544 0.338 . . . . 0.0 110.454 175.212 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.51 -167.75 0.59 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.972 0.909 . . . . 0.0 110.181 173.985 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -48.47 114.66 3.69 Favored Pre-proline 0 N--CA 1.483 1.178 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.592 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.35 -22.2 46.23 Favored 'Trans proline' 0 C--N 1.373 1.858 0 C-N-CA 122.839 2.36 . . . . 0.0 112.786 -164.675 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 117.73 106.41 2.36 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 107.865 -2.094 . . . . 0.0 107.865 -173.194 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -68.44 -29.96 68.74 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 117.391 0.595 . . . . 0.0 111.618 -169.45 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -58.32 -49.64 76.46 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.161 0.584 . . . . 0.0 109.784 171.248 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.72 -30.27 72.74 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.643 -1.162 . . . . 0.0 113.458 179.279 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -74.68 -39.1 62.2 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.495 HD12 HG21 ' A' ' 54' ' ' VAL . 2.4 tm? -65.11 -40.87 95.15 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.444 1.098 . . . . 0.0 110.403 173.332 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.731 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 19.5 tt0 -58.28 -49.97 75.26 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.313 1.445 . . . . 0.0 110.974 175.81 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -66.32 -31.6 72.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.916 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 20.6 tpp180 -62.74 -47.15 84.82 Favored 'General case' 0 C--N 1.351 0.637 0 C-N-CA 122.944 0.498 . . . . 0.0 110.553 174.221 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.407 HG13 ' O ' ' A' ' 20' ' ' LEU . 68.6 mt -60.09 -46.94 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.859 0.725 . . . . 0.0 109.9 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.464 HD12 ' HD3' ' A' ' 63' ' ' LYS . 93.2 mt -62.16 -35.89 80.17 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.547 0.739 . . . . 0.0 110.97 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . 0.504 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 29.8 tt0 -70.28 -44.66 67.94 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.885 0.741 . . . . 0.0 110.567 178.734 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 55.8 t -54.23 -44.59 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.979 0.912 . . . . 0.0 110.938 174.834 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.9 mt -66.26 -37.45 85.51 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -64.22 -51.16 65.01 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.167 0.987 . . . . 0.0 111.605 177.786 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . 0.504 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 15.7 mm-40 -63.29 -46.6 86.0 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.223 0.609 . . . . 0.0 111.444 -173.523 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.95 -38.29 90.46 Favored 'General case' 0 C--O 1.24 0.578 0 O-C-N 124.177 0.923 . . . . 0.0 110.573 178.257 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.57 -56.8 4.91 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.142 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.1 p -72.58 161.92 76.72 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 124.12 0.968 . . . . 0.0 110.835 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -50.41 142.59 29.5 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.982 2.455 . . . . 0.0 113.368 172.442 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 39.6 t -121.79 132.1 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.731 0.812 . . . . 0.0 109.426 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -69.96 148.42 48.94 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.04 0.536 . . . . 0.0 109.806 176.506 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HG ' ' HG3' ' A' ' 48' ' ' LYS . 38.7 tp -60.78 -45.26 95.05 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.679 1.192 . . . . 0.0 110.494 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.63 -37.66 18.82 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.334 1.054 . . . . 0.0 113.509 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -82.48 -28.84 30.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.64 0.376 . . . . 0.0 110.908 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.403 HD11 ' HA ' ' A' ' 37' ' ' LEU . 94.3 mt -60.55 -32.36 71.43 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 122.458 0.303 . . . . 0.0 110.219 174.314 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . . . . . . . . . 27.8 t -56.59 -56.21 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 123.945 0.898 . . . . 0.0 111.789 176.869 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -64.22 -47.08 81.08 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.591 0.557 . . . . 0.0 110.961 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.74 -48.11 82.17 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.453 0.701 . . . . 0.0 112.788 -178.243 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 64.4 m -82.67 -12.29 57.73 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.663 0.385 . . . . 0.0 111.971 -176.885 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 57.23 31.4 20.0 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.779 0.832 . . . . 0.0 111.866 -179.251 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . 0.422 ' HB2' HD22 ' A' ' 51' ' ' LEU . . . -125.14 154.61 71.68 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.727 -174.974 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . 0.448 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 31.1 Cg_endo -62.22 132.31 38.28 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 121.851 1.701 . . . . 0.0 110.961 175.977 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG3' ' HG ' ' A' ' 37' ' ' LEU . 40.5 ttmt -40.01 -43.99 1.66 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.976 1.31 . . . . 0.0 113.42 174.722 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -58.48 -42.3 87.2 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.182 0.993 . . . . 0.0 112.125 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . 0.448 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 10.0 tp10 -64.64 -50.18 68.12 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.698 0.799 . . . . 0.0 109.831 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.422 HD22 ' HB2' ' A' ' 46' ' ' ALA . 51.8 mt -59.42 -54.62 44.59 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.211 1.005 . . . . 0.0 111.503 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . 0.505 ' HA ' HD12 ' A' ' 55' ' ' LEU . 58.2 t30 -50.87 -51.2 53.91 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.282 1.833 . . . . 0.0 112.072 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.6 -43.55 98.52 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 123.729 0.643 . . . . 0.0 111.332 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.495 HG21 HD12 ' A' ' 20' ' ' LEU . 83.1 t -65.54 -35.61 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.505 HD12 ' HA ' ' A' ' 52' ' ' ASN . 30.9 mt -56.94 -37.54 71.66 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.105 0.962 . . . . 0.0 112.82 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -70.03 -33.43 71.97 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.766 0.712 . . . . 0.0 111.085 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -70.72 -48.25 55.57 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.916 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.731 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 74.9 mtm -64.4 -29.11 70.18 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.857 0.863 . . . . 0.0 111.679 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -63.45 -40.98 98.6 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.053 0.541 . . . . 0.0 110.562 175.333 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -71.46 -25.3 62.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.283 0.633 . . . . 0.0 111.135 176.165 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -85.0 -2.53 58.07 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.283 0.633 . . . . 0.0 111.647 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 66.58 17.1 10.57 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.922 1.289 . . . . 0.0 112.469 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.537 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 96.6 mttt -73.2 -38.61 66.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.043 0.937 . . . . 0.0 110.99 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.404 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 18.6 m -127.1 164.41 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.451 0.7 . . . . 0.0 110.14 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.5 m -144.91 151.66 39.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.0 tp -96.03 101.61 13.29 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.6 p -84.69 -41.78 15.93 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.544 0.738 . . . . 0.0 111.557 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.454 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 49.1 m -134.93 167.77 21.12 Favored Pre-proline 0 N--CA 1.481 1.124 0 C-N-CA 123.751 0.82 . . . . 0.0 109.64 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.98 110.78 0.41 Allowed 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 122.976 2.451 . . . . 0.0 112.867 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.8 33.73 17.6 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.982 1.313 . . . . 0.0 111.56 -178.082 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.454 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 51.0 m -129.67 121.76 27.62 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -118.45 142.47 47.53 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.275 1.03 . . . . 0.0 108.315 -174.12 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 33.7 t -130.4 165.74 21.94 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.613 HD12 ' HB ' ' A' ' 77' ' ' THR . 30.2 tp -74.61 102.53 4.6 Favored 'General case' 0 C--O 1.24 0.584 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . 0.404 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . -74.47 -36.9 48.24 Favored Glycine 0 C--N 1.34 0.794 0 O-C-N 123.896 0.748 . . . . 0.0 111.524 -178.313 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . 0.439 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 168.16 98.51 0.12 Allowed Glycine 0 C--N 1.339 0.74 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 176.565 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.613 ' HB ' HD12 ' A' ' 74' ' ' LEU . 6.8 t -73.9 90.9 1.95 Allowed 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 122.075 0.94 . . . . 0.0 109.666 176.651 . . . . . . . . 2 2 . 1 . 017 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -71.12 165.08 51.28 Favored Pre-proline 0 CA--C 1.551 1.0 0 CA-C-N 115.122 -0.944 . . . . 0.0 109.913 176.702 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -37.73 107.37 0.05 OUTLIER 'Trans proline' 0 C--N 1.388 2.607 0 C-N-CA 123.657 2.905 . . . . 0.0 113.985 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 . . . . . 0 C--O 1.248 1.015 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.972 -173.458 . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.4 ptp . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 111.218 0.081 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 018 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.31 164.53 30.6 Favored Glycine 0 C--N 1.36 1.884 0 O-C-N 123.297 0.373 . . . . 0.0 112.41 -175.682 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -70.93 -32.95 70.02 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 170.041 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.1 m-70 -77.72 109.95 12.16 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 166.625 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -72.27 -43.52 64.15 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.959 0.409 . . . . 0.0 110.246 -177.886 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -77.06 137.98 39.28 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.908 170.638 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -92.72 42.64 1.11 Allowed 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -172.502 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -70.77 -30.91 67.53 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.191 0.52 . . . . 0.0 109.967 171.358 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 p -62.14 91.98 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.213 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -68.67 128.02 35.15 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.16 178.398 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 19.1 ptp 38.42 65.29 0.63 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 125.253 1.421 . . . . 0.0 111.459 -173.168 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.92 87.41 0.01 OUTLIER 'General case' 0 C--N 1.351 0.65 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.681 -171.854 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -67.67 125.54 91.4 Favored Pre-proline 0 CA--C 1.532 0.273 0 C-N-CA 124.27 1.028 . . . . 0.0 109.632 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -56.79 148.64 64.94 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 122.4 2.067 . . . . 0.0 110.845 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -132.71 108.52 0.77 Allowed Glycine 0 C--N 1.338 0.64 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -60.91 -42.3 97.78 Favored 'General case' 0 C--O 1.211 -0.948 0 C-N-CA 123.261 0.625 . . . . 0.0 112.421 -167.67 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.15 -57.72 11.33 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.916 0.486 . . . . 0.0 111.027 -176.488 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.9 -44.2 89.55 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 124.045 0.841 . . . . 0.0 114.762 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -70.67 -39.6 73.48 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.929 0.864 . . . . 0.0 110.972 -175.373 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.442 ' O ' HG13 ' A' ' 24' ' ' ILE . 2.4 tm? -64.98 -40.29 94.75 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.348 0.659 . . . . 0.0 110.1 174.788 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -58.66 -47.76 83.37 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.295 1.038 . . . . 0.0 111.395 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -36.88 82.8 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.039 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.4 ' O ' HG21 ' A' ' 27' ' ' VAL . 16.4 tpt180 -67.41 -41.63 84.56 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.083 0.553 . . . . 0.0 111.011 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.459 ' HB ' ' HE2' ' A' ' 58' ' ' MET . 79.4 mt -60.28 -52.93 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 122.836 0.454 . . . . 0.0 110.432 176.369 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.18 -32.68 72.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.503 0.721 . . . . 0.0 111.09 -178.458 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -63.55 -52.13 62.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.354 1.061 . . . . 0.0 109.926 176.993 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.4 HG21 ' O ' ' A' ' 23' ' ' ARG . 76.1 t -58.2 -41.86 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.966 0.906 . . . . 0.0 110.591 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.471 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 97.5 mt -69.88 -36.0 75.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.302 0.641 . . . . 0.0 111.695 -177.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -70.44 -45.04 66.61 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.359 0.663 . . . . 0.0 111.861 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -71.81 -33.42 68.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.948 0.499 . . . . 0.0 111.326 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.79 68.98 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 168.822 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.84 26.53 67.2 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.643 -175.689 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.1 t -152.53 150.6 25.3 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.262 1.025 . . . . 0.0 109.028 -171.307 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.19 125.11 15.49 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.675 2.25 . . . . 0.0 113.32 173.185 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.94 132.8 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.143 0.977 . . . . 0.0 108.521 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . 0.5 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 54.7 mtpt -64.35 151.7 43.24 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.492 0.717 . . . . 0.0 111.19 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.407 ' O ' HG21 ' A' ' 41' ' ' VAL . 51.9 tp -62.4 -50.51 71.26 Favored 'General case' 0 C--N 1.356 0.855 0 O-C-N 123.424 0.452 . . . . 0.0 109.852 176.382 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.03 -37.95 10.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.99 0.916 . . . . 0.0 112.848 170.919 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . 0.402 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 61.6 tt0 -78.31 -34.66 48.57 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.253 0.621 . . . . 0.0 110.619 -179.475 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 66.9 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.601 0.761 . . . . 0.0 110.815 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.407 HG21 ' O ' ' A' ' 37' ' ' LEU . 35.8 t -55.49 -50.88 63.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.37 0.668 . . . . 0.0 111.706 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -76.26 -43.62 41.05 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.986 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . 0.402 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -59.59 -56.51 20.96 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.274 0.488 . . . . 0.0 112.039 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 62.7 m -72.74 -8.39 55.16 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.827 0.451 . . . . 0.0 111.632 -177.807 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 61.9 22.87 13.37 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.017 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.84 149.01 58.35 Favored Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.92 -164.417 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.47 133.14 29.2 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.508 2.139 . . . . 0.0 111.761 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -42.15 -36.14 1.11 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.734 1.613 . . . . 0.0 112.934 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.9 ttm105 -54.6 -56.62 17.09 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.355 1.062 . . . . 0.0 112.21 176.222 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -44.75 79.53 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.873 -176.787 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.7 mt -55.37 -59.71 4.43 Favored 'General case' 0 C--O 1.212 -0.881 0 O-C-N 124.082 0.864 . . . . 0.0 111.093 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -48.4 -56.12 9.01 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.278 1.431 . . . . 0.0 112.089 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.33 -52.61 64.63 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.779 0.832 . . . . 0.0 112.101 -177.441 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.54 HG12 ' SD ' ' A' ' 58' ' ' MET . 97.4 t -67.05 -38.0 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 122.821 0.448 . . . . 0.0 110.204 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . 0.444 HD21 HG23 ' A' ' 24' ' ' ILE . 17.4 mt -54.06 -40.38 67.1 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.685 1.194 . . . . 0.0 114.137 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -71.76 -24.32 61.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 119.436 1.016 . . . . 0.0 111.365 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -73.61 -48.82 29.76 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.54 ' SD ' HG12 ' A' ' 54' ' ' VAL . 66.0 mtp -60.68 -37.74 82.64 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.603 1.161 . . . . 0.0 111.476 179.3 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -58.51 -45.97 87.69 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.424 1.09 . . . . 0.0 110.599 175.397 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . 0.551 ' HZ2' ' HB2' ' A' ' 60' ' ' LYS . 4.3 ttmp? -72.77 -26.45 61.54 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.096 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -85.52 -2.17 57.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.831 0.852 . . . . 0.0 111.265 174.551 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 69.95 12.17 7.81 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.978 1.311 . . . . 0.0 112.306 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.411 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 94.4 mttt -70.03 -37.13 75.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.726 0.81 . . . . 0.0 110.792 175.272 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.432 HG11 ' HE1' ' A' ' 58' ' ' MET . 22.2 m -131.25 175.77 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.734 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.3 t -144.13 158.13 43.9 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 30.5 tp -109.56 113.16 25.72 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 175.764 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.6 p -100.47 -31.95 11.04 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.572 0.749 . . . . 0.0 111.283 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.692 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 39.2 t -139.23 148.37 56.82 Favored Pre-proline 0 CA--C 1.552 1.035 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -26.0 -72.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.39 2.739 1 C-N-CA 125.407 4.071 . . . . 0.0 116.721 -172.39 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.84 39.34 2.4 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.345 0.658 . . . . 0.0 111.008 177.013 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.692 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 86.2 m -131.27 123.02 27.48 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.801 0.84 . . . . 0.0 109.239 176.535 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -104.51 160.34 15.01 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.622 -173.133 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 51.8 t -138.63 156.17 47.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . 0.511 HD22 ' HB ' ' A' ' 77' ' ' THR . 35.7 tp -76.21 131.03 39.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.393 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -108.35 -55.94 0.58 Allowed Glycine 0 C--N 1.343 0.924 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 178.377 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -138.89 102.88 0.37 Allowed Glycine 0 C--N 1.335 0.49 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 77' ' ' THR . . . . . 0.511 ' HB ' HD22 ' A' ' 74' ' ' LEU . 11.4 t -100.96 172.6 6.93 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.553 0.741 . . . . 0.0 110.628 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -158.16 58.4 1.38 Allowed Pre-proline 0 CA--C 1.561 1.393 0 C-N-CA 123.583 0.753 . . . . 0.0 110.186 179.219 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -88.56 -156.84 0.06 OUTLIER 'Trans proline' 0 C--N 1.378 2.104 0 C-N-CA 123.0 2.466 . . . . 0.0 112.331 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 . . . . . 0 C--O 1.249 1.077 0 C-N-CA 123.479 0.712 . . . . 0.0 110.072 -179.259 . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.32 0.105 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 019 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.78 -5.19 37.27 Favored Glycine 0 C--N 1.348 1.248 0 N-CA-C 116.14 1.216 . . . . 0.0 116.14 -171.378 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -63.47 -33.31 75.29 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 117.922 0.861 . . . . 0.0 110.532 173.399 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -81.21 76.71 8.14 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.967 177.7 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.0 m170 -149.59 156.19 41.53 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.82 1.248 . . . . 0.0 108.667 176.687 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -79.27 87.27 4.97 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-O 121.598 0.713 . . . . 0.0 109.923 177.469 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -81.3 -41.53 21.98 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -122.66 107.84 12.41 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.084 0.954 . . . . 0.0 108.44 177.594 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 30.9 t -174.55 -8.74 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.509 0.724 . . . . 0.0 111.758 -177.591 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 58.3 t-80 64.73 78.29 0.29 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.824 1.25 . . . . 0.0 111.066 -179.84 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -62.58 115.08 3.96 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.381 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -156.36 35.86 0.33 Allowed 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 121.792 0.806 . . . . 0.0 109.412 -175.339 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -151.39 171.35 6.6 Favored Pre-proline 0 CA--C 1.549 0.929 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.349 -172.519 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -65.34 -130.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.382 2.325 0 C-N-CA 122.438 2.092 . . . . 0.0 112.61 169.731 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.47 -58.27 3.05 Favored Glycine 0 C--N 1.348 1.209 0 O-C-N 121.353 -0.842 . . . . 0.0 114.375 -175.233 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -62.25 -44.57 96.25 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -170.424 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -65.47 -44.11 88.19 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 123.194 0.308 . . . . 0.0 110.517 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.05 -32.06 81.31 Favored Glycine 0 C--N 1.342 0.865 0 O-C-N 123.5 0.5 . . . . 0.0 113.369 174.891 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -65.58 -45.28 83.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.439 0.638 . . . . 0.0 109.403 176.099 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.567 HD13 HG21 ' A' ' 54' ' ' VAL . 2.3 tm? -67.4 -37.63 83.4 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 113.943 -1.481 . . . . 0.0 111.404 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.473 ' HG3' ' HE1' ' A' ' 58' ' ' MET . 38.9 tt0 -65.18 -43.19 92.48 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.015 0.926 . . . . 0.0 110.709 176.923 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -66.9 -34.42 77.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.753 175.458 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.477 ' HB3' ' HA ' ' A' ' 44' ' ' CYS . 0.6 OUTLIER -59.48 -52.7 64.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.234 0.614 . . . . 0.0 110.791 174.185 . . . . . . . . 3 3 . 1 . 019 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.466 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.3 mt -55.57 -48.81 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 O-C-N 124.251 0.969 . . . . 0.0 110.449 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.545 HD21 ' HB3' ' A' ' 63' ' ' LYS . 89.0 mt -62.56 -37.14 84.99 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.217 0.607 . . . . 0.0 111.568 -178.838 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -66.74 -47.92 70.77 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.743 0.652 . . . . 0.0 110.465 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.495 HG22 ' SG ' ' A' ' 44' ' ' CYS . 85.2 t -56.79 -40.49 71.1 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.153 0.981 . . . . 0.0 110.885 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.466 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 93.4 mt -69.47 -38.82 77.88 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.069 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.2 m -69.37 -45.97 68.07 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.546 0.738 . . . . 0.0 111.677 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -68.88 -34.83 76.08 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.437 0.695 . . . . 0.0 110.613 -176.796 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.76 83.23 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.7 171.161 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.7 28.89 68.76 Favored Glycine 0 C--N 1.352 1.429 0 O-C-N 123.946 0.779 . . . . 0.0 111.853 -171.024 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.5 t -162.19 147.51 10.13 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.41 1.084 . . . . 0.0 109.057 -165.754 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . 0.424 ' HG3' ' HB2' ' A' ' 73' ' ' CYS . 74.3 Cg_exo -51.86 114.77 1.75 Allowed 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 123.163 2.575 . . . . 0.0 113.757 174.79 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 90.1 t -96.37 146.75 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.056 0.942 . . . . 0.0 109.691 179.214 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -82.01 152.56 26.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.505 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.425 ' HA ' HD11 ' A' ' 40' ' ' LEU . 39.1 tp -57.61 -49.46 76.35 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.517 1.127 . . . . 0.0 111.053 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.66 -32.58 42.9 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -83.88 -27.48 28.62 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.959 0.409 . . . . 0.0 110.199 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . 0.425 HD11 ' HA ' ' A' ' 37' ' ' LEU . 91.6 mt -65.64 -28.65 69.26 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.581 0.753 . . . . 0.0 110.504 174.061 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.572 ' HA ' HD11 ' A' ' 51' ' ' LEU . 91.8 t -56.21 -52.3 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.004 0.522 . . . . 0.0 111.926 -178.565 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -71.5 -50.73 28.65 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 123.561 0.538 . . . . 0.0 111.166 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.9 -49.38 46.44 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 123.492 0.717 . . . . 0.0 111.391 -172.777 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . 0.495 ' SG ' HG22 ' A' ' 27' ' ' VAL . 54.6 m -76.46 -11.7 59.92 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.511 0.324 . . . . 0.0 111.276 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 62.85 51.3 3.01 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.266 1.026 . . . . 0.0 111.644 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -149.74 152.06 33.97 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 123.007 0.523 . . . . 0.0 110.652 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.83 145.92 94.85 Favored 'Trans proline' 0 C--N 1.366 1.5 0 C-N-CA 122.496 2.131 . . . . 0.0 111.727 173.127 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.53 ' HZ1' ' HB2' ' A' ' 48' ' ' LYS . 4.6 ttmp? -39.44 -56.58 1.58 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.87 1.268 . . . . 0.0 113.735 177.6 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -58.11 -36.37 72.8 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.611 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.94 -48.3 74.57 Favored 'General case' 0 C--O 1.245 0.853 0 O-C-N 123.54 0.525 . . . . 0.0 109.978 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.572 HD11 ' HA ' ' A' ' 41' ' ' VAL . 57.3 mt -55.35 -53.25 58.49 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 124.521 1.138 . . . . 0.0 111.52 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -49.76 -50.1 45.82 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 124.383 1.052 . . . . 0.0 112.285 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -56.79 -46.52 81.5 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 124.313 1.008 . . . . 0.0 111.067 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.567 HG21 HD13 ' A' ' 20' ' ' LEU . 54.0 t -70.32 -43.16 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.877 0.471 . . . . 0.0 110.835 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 60.8 mt -51.9 -49.67 62.57 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.03 1.332 . . . . 0.0 114.078 179.621 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -71.69 -26.31 62.46 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 118.08 0.4 . . . . 0.0 110.927 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . 0.413 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.8 tmt_? -68.43 -52.28 34.52 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.479 0.711 . . . . 0.0 109.431 174.462 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.499 ' SD ' HG12 ' A' ' 54' ' ' VAL . 83.3 mtp -61.11 -29.25 69.65 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.695 1.198 . . . . 0.0 111.498 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -63.78 -41.96 97.86 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.944 0.497 . . . . 0.0 110.575 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -71.49 -28.55 64.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 123.83 0.706 . . . . 0.0 110.758 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . 0.413 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.01 -2.65 45.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.125 0.57 . . . . 0.0 110.921 173.201 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 74.4 mt 63.88 16.11 9.6 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.036 1.334 . . . . 0.0 112.115 178.62 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.545 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.9 mttt -77.06 -32.46 56.85 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.257 1.023 . . . . 0.0 110.637 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . 0.494 HG11 ' HE2' ' A' ' 58' ' ' MET . 22.0 m -129.51 164.18 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 26.7 t -137.11 148.25 46.56 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.53 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.0 tp -100.57 106.58 18.1 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 11.6 p -88.18 -43.97 11.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.902 0.881 . . . . 0.0 111.063 -176.869 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.41 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 34.3 t -140.73 153.71 68.14 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -177.135 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.02 112.75 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.528 0 C-N-CA 123.235 2.623 . . . . 0.0 114.608 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 68.73 20.41 8.17 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.856 1.262 . . . . 0.0 112.075 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 71' ' ' THR . . . . . 0.41 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 6.2 m -126.04 115.48 19.93 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.713 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -115.99 142.98 46.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.712 0.805 . . . . 0.0 109.797 -167.704 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . 0.424 ' HB2' ' HG3' ' A' ' 34' ' ' PRO . 53.4 t -113.94 161.47 17.6 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 123.223 0.609 . . . . 0.0 110.213 177.712 . . . . . . . . 2 2 . 1 . 019 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.58 102.38 0.9 Allowed 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.511 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -79.08 -35.2 31.17 Favored Glycine 0 C--N 1.343 0.924 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.647 -178.589 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.74 46.95 3.51 Favored Glycine 0 C--N 1.347 1.167 0 N-CA-C 111.561 -0.615 . . . . 0.0 111.561 176.307 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.5 t -79.99 89.2 5.33 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.926 0.89 . . . . 0.0 109.93 -179.407 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 50.37 69.52 2.57 Favored Pre-proline 0 N--CA 1.478 0.948 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.151 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.88 -52.44 8.0 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 123.576 2.851 . . . . 0.0 112.608 -174.476 . . . . . . . . 1 1 . 1 . 019 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 C--O 1.252 1.19 0 O-C-N 124.294 0.996 . . . . 0.0 108.812 177.872 . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.8 tpt . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 . . . . . . . . . 0 0 . 1 . 020 nuclear orig full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.53 175.36 53.21 Favored Glycine 0 CA--C 1.528 0.891 0 O-C-N 123.46 0.475 . . . . 0.0 112.763 177.091 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.3 m170 63.54 -84.62 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.789 1.235 . . . . 0.0 110.931 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -90.47 69.91 6.9 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.982 0.896 . . . . 0.0 109.759 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.9 p80 -85.2 54.75 3.21 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.424 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -68.99 -35.39 76.65 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.464 1.106 . . . . 0.0 111.787 -170.373 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 p-80 49.53 -66.46 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 127.093 2.157 . . . . 0.0 114.929 -176.177 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 74.29 -16.5 0.53 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 125.38 1.472 . . . . 0.0 114.439 167.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 m -88.39 72.09 8.95 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 118.499 0.59 . . . . 0.0 110.091 -177.013 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -86.94 74.02 9.82 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.556 0.743 . . . . 0.0 109.975 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 23.6 mmt 70.51 -68.33 0.21 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 126.071 1.748 . . . . 0.0 111.234 -177.923 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.57 -172.31 2.13 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.776 1.23 . . . . 0.0 109.443 178.342 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 72.71 141.35 0.08 OUTLIER Pre-proline 0 N--CA 1.487 1.398 0 C-N-CA 124.996 1.318 . . . . 0.0 113.45 168.961 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -89.21 16.29 1.83 Allowed 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 123.397 2.731 . . . . 0.0 113.348 175.487 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -47.47 -27.87 4.47 Favored Glycine 0 C--N 1.353 1.514 0 N-CA-C 115.411 0.925 . . . . 0.0 115.411 175.268 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.0 ttm-85 -61.65 -33.59 74.22 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 123.733 0.813 . . . . 0.0 111.643 177.739 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -55.43 -44.65 76.48 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.674 0.39 . . . . 0.0 110.852 176.659 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.62 -32.82 61.29 Favored Glycine 0 C--N 1.347 1.174 0 O-C-N 124.262 0.976 . . . . 0.0 114.275 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -67.47 -51.97 44.91 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.818 0.447 . . . . 0.0 110.555 176.155 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 20' ' ' LEU . . . . . 0.497 HD13 HD23 ' A' ' 51' ' ' LEU . 2.7 tm? -63.44 -37.18 86.29 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.996 1.319 . . . . 0.0 110.652 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 21' ' ' GLU . . . . . 0.746 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 29.3 tt0 -56.56 -48.72 76.73 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.537 1.135 . . . . 0.0 110.305 171.235 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -62.84 -38.88 92.54 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.152 -177.338 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 23' ' ' ARG . . . . . 0.483 ' O ' HG21 ' A' ' 27' ' ' VAL . 26.8 mmt180 -64.96 -51.91 59.18 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 122.764 0.425 . . . . 0.0 111.477 178.661 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 24' ' ' ILE . . . . . 0.463 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 61.6 mt -57.35 -47.85 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 O-C-N 123.865 0.728 . . . . 0.0 110.514 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 25' ' ' LEU . . . . . 0.429 HD23 ' HB3' ' A' ' 63' ' ' LYS . 94.3 mt -65.55 -32.95 74.81 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.189 0.596 . . . . 0.0 111.422 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -69.94 -43.02 72.44 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.497 0.498 . . . . 0.0 110.102 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 27' ' ' VAL . . . . . 0.483 HG21 ' O ' ' A' ' 23' ' ' ARG . 87.8 t -56.57 -43.5 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.684 0.794 . . . . 0.0 110.748 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 28' ' ' LEU . . . . . 0.463 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 79.9 mt -66.56 -42.82 86.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.293 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.5 m -72.85 -38.17 67.17 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.187 0.995 . . . . 0.0 111.91 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.51 -42.65 74.43 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.751 0.42 . . . . 0.0 110.644 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.99 -36.94 83.28 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.722 0.639 . . . . 0.0 110.862 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 59.11 34.12 77.93 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 124.155 0.909 . . . . 0.0 112.508 -174.81 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.9 t -164.29 151.56 10.25 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.459 1.104 . . . . 0.0 108.615 -166.949 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.59 118.87 5.56 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.366 2.711 . . . . 0.0 112.607 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 46.6 t -102.96 127.58 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -68.95 150.49 47.66 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.421 0.689 . . . . 0.0 110.709 -178.253 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 37' ' ' LEU . . . . . 0.507 HD21 ' HG3' ' A' ' 48' ' ' LYS . 57.6 tp -58.58 -46.78 86.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.076 0.95 . . . . 0.0 111.373 -179.431 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.86 -35.93 46.67 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.937 0.895 . . . . 0.0 113.269 171.328 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.33 -34.13 48.78 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.9 mt -64.18 -33.42 75.74 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.954 0.902 . . . . 0.0 110.728 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 41' ' ' VAL . . . . . 0.563 ' HA ' HD13 ' A' ' 51' ' ' LEU . 83.4 t -58.91 -47.74 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 123.318 0.647 . . . . 0.0 110.259 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -67.4 -54.04 23.94 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.28 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -70.29 -48.95 54.36 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.803 0.841 . . . . 0.0 112.867 -171.703 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 44.3 m -77.31 -16.06 59.12 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 62.74 56.28 1.96 Allowed 'General case' 0 C--N 1.364 1.215 0 C-N-CA 124.295 1.038 . . . . 0.0 110.574 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.43 151.32 36.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.105 -173.626 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -59.54 137.61 78.74 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.834 2.356 . . . . 0.0 111.969 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 48' ' ' LYS . . . . . 0.507 ' HG3' HD21 ' A' ' 37' ' ' LEU . 22.7 ttmm -35.1 -48.35 0.42 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.595 1.558 . . . . 0.0 112.945 169.741 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -61.33 -48.34 81.8 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 111.82 -178.912 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.9 -46.72 86.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.287 0.635 . . . . 0.0 110.164 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 51' ' ' LEU . . . . . 0.563 HD13 ' HA ' ' A' ' 41' ' ' VAL . 83.6 mt -52.79 -53.71 44.43 Favored 'General case' 0 C--O 1.206 -1.204 0 O-C-N 124.353 1.033 . . . . 0.0 110.735 174.434 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -59.21 -46.37 88.64 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.582 1.177 . . . . 0.0 112.766 -175.58 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.61 -43.21 72.0 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.428 0.455 . . . . 0.0 111.254 176.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 54' ' ' VAL . . . . . 0.459 HG21 HD12 ' A' ' 20' ' ' LEU . 50.7 t -72.79 -39.35 59.45 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.987 176.821 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.2 -53.88 53.24 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.781 1.232 . . . . 0.0 114.232 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -69.84 -26.31 64.16 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 119.557 1.071 . . . . 0.0 110.49 -176.733 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -65.03 -53.26 48.81 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.037 0.935 . . . . 0.0 109.387 171.722 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 58' ' ' MET . . . . . 0.746 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 73.3 mtm -64.04 -26.92 68.78 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.51 1.124 . . . . 0.0 111.906 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -66.86 -41.1 87.86 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.564 0.746 . . . . 0.0 110.347 176.768 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -63.45 -40.33 96.85 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.477 0.711 . . . . 0.0 109.939 172.216 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.77 0.65 22.9 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.852 0.861 . . . . 0.0 111.944 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.8 mt 67.96 10.45 7.81 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 125.881 1.672 . . . . 0.0 113.298 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 63' ' ' LYS . . . . . 0.554 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 55.0 mttm -69.24 -44.12 72.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.479 1.112 . . . . 0.0 110.533 177.732 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 26.8 m -123.32 164.41 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.657 0.783 . . . . 0.0 109.778 -178.472 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.2 t -147.03 157.64 43.68 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.723 0.809 . . . . 0.0 109.034 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 30.8 tp -101.5 106.89 18.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -178.187 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.2 p -86.08 -40.39 15.77 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.237 0.615 . . . . 0.0 110.748 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 68' ' ' SER . . . . . 0.415 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 16.0 p -142.21 160.65 54.15 Favored Pre-proline 0 CA--C 1.558 1.285 0 CA-C-O 117.753 -1.118 . . . . 0.0 108.357 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear orig full ' A' A ' 69' ' ' PRO . . . . . 0.415 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 37.2 Cg_exo -22.97 -70.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.393 2.892 1 C-N-CA 126.099 4.533 . . . . 0.0 117.79 -168.426 . . . . . . . . 3 3 . 1 . 020 nuclear orig full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.34 42.08 2.49 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.637 0.775 . . . . 0.0 110.506 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 59.3 m -130.16 125.95 36.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.677 0.791 . . . . 0.0 109.92 -177.747 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -115.5 136.06 53.46 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.652 0.781 . . . . 0.0 109.259 -174.198 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 32.3 t -118.31 171.52 8.08 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.0 tp -68.83 104.75 2.13 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 173.079 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.01 -52.05 25.59 Favored Glycine 0 C--N 1.348 1.215 0 O-C-N 123.946 0.779 . . . . 0.0 111.379 -178.212 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.65 -155.42 23.07 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 114.854 -0.673 . . . . 0.0 112.128 173.954 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.3 t -169.1 165.98 11.01 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 123.205 0.602 . . . . 0.0 110.348 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -131.71 128.05 21.59 Favored Pre-proline 0 N--CA 1.471 0.608 0 C-N-CA 123.835 0.854 . . . . 0.0 108.875 176.207 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -70.4 79.3 1.15 Allowed 'Trans proline' 0 C--N 1.375 1.936 0 C-N-CA 123.136 2.557 . . . . 0.0 111.913 176.368 . . . . . . . . 1 1 . 1 . 020 nuclear orig full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.944 0 N-CA-C 106.503 -1.665 . . . . 0.0 106.503 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 N--CA 1.477 0.906 0 CA-C-O 119.475 -0.298 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 001 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -62.93 -44.44 97.4 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-O 119.446 -0.641 . . . . 0.0 112.855 171.295 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -66.87 -42.9 84.85 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.51 0.671 . . . . 0.0 109.745 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.457 HD11 HD23 ' A' ' 51' ' ' LEU . 2.0 tm? -62.42 -41.41 98.68 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.609 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -64.42 -42.82 95.84 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.673 0.789 . . . . 0.0 110.33 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 99.3 mt-30 -62.31 -36.25 81.57 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.06 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.532 ' O ' HG23 ' A' ' 27' ' ' VAL . 34.9 mmm-85 -64.84 -50.66 65.77 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 123.702 0.626 . . . . 0.0 110.852 175.418 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 80.2 mt -56.63 -50.39 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 124.141 0.9 . . . . 0.0 109.864 -176.269 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.574 HD21 ' HB3' ' A' ' 63' ' ' LYS . 96.1 mt -61.69 -37.84 85.62 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.594 0.758 . . . . 0.0 111.274 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -69.58 -44.47 70.75 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.016 0.926 . . . . 0.0 110.517 -176.981 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 23' ' ' ARG . 94.4 t -60.1 -43.12 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.95 0.9 . . . . 0.0 110.241 176.467 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 80.6 mt -64.48 -34.96 79.42 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.853 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.6 m -74.52 -43.15 57.25 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 123.644 0.778 . . . . 0.0 111.283 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -62.67 -41.57 99.15 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.451 0.7 . . . . 0.0 110.361 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -41.91 92.6 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.976 0.798 . . . . 0.0 110.417 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 63.62 27.61 71.24 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.464 -170.062 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.9 m -159.16 161.74 27.28 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.016 1.326 . . . . 0.0 109.611 -166.873 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -53.84 125.85 20.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 122.802 2.335 . . . . 0.0 113.473 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.476 HG21 HG12 ' A' ' 27' ' ' VAL . 76.8 t -107.37 130.45 59.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.18 0.992 . . . . 0.0 108.392 174.54 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.32 151.59 47.2 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.639 0.776 . . . . 0.0 110.499 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.406 ' O ' HG23 ' A' ' 41' ' ' VAL . 54.5 tp -63.04 -49.01 76.24 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.969 0.907 . . . . 0.0 110.425 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -50.09 -37.6 34.59 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.822 0.849 . . . . 0.0 112.333 170.941 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.424 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 46.3 tt0 -73.95 -36.38 64.62 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.88 -31.51 72.56 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.272 0.629 . . . . 0.0 110.393 178.488 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.518 ' HA ' HD11 ' A' ' 51' ' ' LEU . 45.4 t -57.85 -54.03 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 O-C-N 123.573 0.546 . . . . 0.0 110.717 174.903 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HE3' ' HG3' ' A' ' 39' ' ' GLN . 20.6 pttp -75.13 -39.21 60.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.499 -173.796 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -65.39 -58.21 6.44 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.42 0.688 . . . . 0.0 111.87 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 37.6 m -80.97 -4.36 54.79 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.817 0.447 . . . . 0.0 111.252 -173.717 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 62.08 31.25 17.91 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.12 1.368 . . . . 0.0 111.597 171.219 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -128.47 150.06 73.41 Favored Pre-proline 0 N--CA 1.476 0.873 0 C-N-CA 123.52 0.728 . . . . 0.0 110.344 -175.858 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.2 142.07 71.99 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.458 2.106 . . . . 0.0 111.757 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -43.46 -41.3 4.24 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.769 1.228 . . . . 0.0 112.051 172.893 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -54.09 -51.69 63.36 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.362 1.065 . . . . 0.0 111.625 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -66.49 -44.9 81.36 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.568 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.518 HD11 ' HA ' ' A' ' 41' ' ' VAL . 98.5 mt -54.75 -51.17 66.52 Favored 'General case' 0 C--O 1.212 -0.879 0 O-C-N 124.43 1.081 . . . . 0.0 111.253 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -48.74 -56.75 7.73 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.087 0.955 . . . . 0.0 112.194 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -58.93 -41.89 88.46 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 123.997 0.81 . . . . 0.0 112.115 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.506 HG13 HH21 ' A' ' 57' ' ' ARG . 86.1 t -68.95 -48.31 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 122.987 0.515 . . . . 0.0 110.259 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -55.59 -38.29 69.2 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.563 1.545 . . . . 0.0 114.178 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -70.41 -30.78 67.75 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 118.767 0.712 . . . . 0.0 110.792 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.506 HH21 HG13 ' A' ' 54' ' ' VAL . 46.5 ttp180 -71.42 -44.23 65.26 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.858 0.724 . . . . 0.0 109.348 176.389 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.461 ' SD ' HG12 ' A' ' 54' ' ' VAL . 80.5 mtp -63.55 -31.98 73.3 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.335 1.054 . . . . 0.0 111.046 176.0 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.52 -44.92 95.17 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.708 0.803 . . . . 0.0 110.611 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 57' ' ' ARG . 52.7 mttm -63.02 -35.9 81.77 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.623 0.769 . . . . 0.0 110.749 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -85.88 5.25 33.74 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.555 0.742 . . . . 0.0 111.312 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.8 mt 66.36 9.95 6.84 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 125.218 1.407 . . . . 0.0 113.016 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.574 ' HB3' HD21 ' A' ' 25' ' ' LEU . 94.2 mttt -69.11 -35.34 76.32 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.372 1.069 . . . . 0.0 111.094 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.5 m -129.8 158.67 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.613 0.765 . . . . 0.0 109.919 177.586 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.1 m -132.92 152.85 51.83 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.421 1.089 . . . . 0.0 108.075 172.78 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.96 112.77 24.58 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.1 p -87.58 -37.72 16.59 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.12 0.568 . . . . 0.0 111.553 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.624 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 9.2 t -140.59 155.09 69.75 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -176.663 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -26.18 -68.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.391 2.799 0 C-N-CA 125.071 3.847 . . . . 0.0 116.495 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.22 41.35 2.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.186 0.594 . . . . 0.0 110.902 176.138 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.624 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 26.5 m -129.37 125.71 37.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.641 0.776 . . . . 0.0 108.955 174.752 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -108.27 163.83 12.85 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.802 0.841 . . . . 0.0 109.219 -175.691 . . . . . . . . 1 1 . 1 . 001 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.428 ' HA ' HD22 ' A' ' 28' ' ' LEU . 43.9 t -146.3 164.02 33.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 177.195 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.444 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 35.2 tp -68.35 135.38 51.75 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.415 -0.958 . . . . 0.0 108.415 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 1.393 0 O-C-N 124.174 0.922 . . . . 0.0 111.608 179.348 . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 119.661 -0.209 . . . . 0.0 111.524 . . . . . . . . . 0 0 . 1 . 002 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.42 -52.76 47.97 Favored Glycine 0 C--N 1.346 1.134 0 N-CA-C 114.371 0.508 . . . . 0.0 114.371 171.68 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -67.27 -36.04 80.76 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.961 0.504 . . . . 0.0 110.155 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.421 ' O ' HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -64.37 -51.88 61.08 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.123 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.29 -47.43 79.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.96 0.904 . . . . 0.0 111.108 -175.444 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -38.11 85.7 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 124.067 0.854 . . . . 0.0 110.739 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.434 ' O ' HG23 ' A' ' 27' ' ' VAL . 14.1 tpp180 -71.83 -38.51 70.15 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 122.986 0.514 . . . . 0.0 110.857 -178.094 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 20' ' ' LEU . 82.5 mt -58.76 -51.76 68.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 122.806 0.443 . . . . 0.0 109.934 174.592 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.409 HD21 ' HB3' ' A' ' 63' ' ' LYS . 98.6 mt -56.1 -43.15 77.82 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 123.672 0.789 . . . . 0.0 110.905 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -61.64 -51.18 69.51 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 124.194 0.934 . . . . 0.0 111.12 -175.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 23' ' ' ARG . 87.7 t -57.82 -41.97 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 124.133 0.896 . . . . 0.0 110.971 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.05 -33.11 71.53 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.252 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.6 m -71.64 -49.43 40.08 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 123.432 0.693 . . . . 0.0 112.12 177.928 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.51 -36.46 82.64 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.21 0.604 . . . . 0.0 110.268 -176.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.62 -38.35 70.81 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.815 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.52 22.98 64.33 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 124.031 0.832 . . . . 0.0 113.342 -176.859 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.6 m -152.62 164.88 18.89 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.149 0.98 . . . . 0.0 109.724 -167.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -58.93 117.09 3.76 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 122.364 2.043 . . . . 0.0 112.509 172.397 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.4 t -111.31 133.2 57.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.625 1.17 . . . . 0.0 108.573 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 59.4 mtpt -68.77 144.58 54.29 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.347 0.659 . . . . 0.0 109.875 177.886 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.478 HD13 HD11 ' A' ' 55' ' ' LEU . 29.1 tp -58.48 -40.44 82.74 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.721 0.638 . . . . 0.0 110.808 176.204 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.02 -44.83 2.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.418 1.087 . . . . 0.0 113.16 167.133 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -81.66 -32.61 31.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.346 0.258 . . . . 0.0 110.536 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.3 mt -58.62 -33.52 70.13 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.666 0.387 . . . . 0.0 110.194 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 37' ' ' LEU . 99.0 t -52.8 -58.8 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.78 0.832 . . . . 0.0 112.285 173.49 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -70.5 -40.96 73.27 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -69.33 -43.58 73.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 82.0 m -77.77 -15.47 59.08 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 61.28 26.15 16.03 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.786 0.835 . . . . 0.0 110.296 -173.698 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.91 143.75 31.4 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 124.124 0.969 . . . . 0.0 110.081 -171.652 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.66 138.32 41.23 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.583 2.189 . . . . 0.0 111.615 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -47.99 -30.3 4.19 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.218 1.407 . . . . 0.0 112.721 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 mtm180 -56.45 -56.69 18.01 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.143 0.977 . . . . 0.0 111.136 174.871 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -66.23 -43.01 87.82 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.21 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.7 mt -54.74 -52.9 61.07 Favored 'General case' 0 C--O 1.209 -1.048 0 O-C-N 124.448 1.093 . . . . 0.0 110.098 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -47.53 -58.9 3.67 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.283 1.033 . . . . 0.0 112.08 176.363 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -53.51 -50.88 64.48 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.226 1.01 . . . . 0.0 112.339 -177.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.29 -43.68 84.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 C-N-CA 123.147 0.579 . . . . 0.0 111.462 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.478 HD11 HD13 ' A' ' 37' ' ' LEU . 27.8 mt -48.19 -48.5 34.66 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.992 1.317 . . . . 0.0 114.265 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -72.48 -25.62 61.49 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.392 0.996 . . . . 0.0 111.86 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -70.31 -55.34 9.42 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.459 ' HB2' ' HB2' ' A' ' 63' ' ' LYS . 18.0 ptm -67.99 -23.85 65.07 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.922 -178.29 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.2 tttm -69.15 -43.1 74.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.608 0.763 . . . . 0.0 110.72 171.663 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.407 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -59.19 -37.88 78.48 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.98 0.912 . . . . 0.0 110.577 175.298 . . . . . . . . 3 3 . 1 . 002 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -86.21 -0.49 55.87 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 115.056 -0.975 . . . . 0.0 112.038 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.3 mt 60.8 24.72 14.62 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.068 1.347 . . . . 0.0 112.688 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 58' ' ' MET . 55.1 mttm -67.5 -32.13 72.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.505 1.122 . . . . 0.0 109.569 168.25 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.458 HG22 ' HG3' ' A' ' 58' ' ' MET . 28.1 m -133.37 160.79 42.17 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.558 171.719 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.1 m -129.85 156.46 44.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 171.541 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.4 tp -103.07 112.4 25.22 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.9 p -94.9 -43.82 8.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.696 0.399 . . . . 0.0 111.23 -174.597 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.694 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 19.6 m -132.93 162.34 58.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.478 0.711 . . . . 0.0 110.183 -175.274 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.6 115.86 2.75 Favored 'Trans proline' 0 C--N 1.379 2.175 0 C-N-CA 122.972 2.448 . . . . 0.0 112.247 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 70.54 9.89 7.02 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.42 1.488 . . . . 0.0 112.386 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.694 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 28.0 m -124.58 121.77 35.7 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.258 0.623 . . . . 0.0 109.418 -174.501 . . . . . . . . 2 2 . 1 . 002 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -107.67 165.83 11.14 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.272 1.029 . . . . 0.0 109.591 -172.306 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 52.2 t -146.15 158.58 43.88 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 43.5 tp -69.46 138.35 53.38 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.477 0.486 . . . . 0.0 110.186 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.969 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 176.116 . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 . . . . . 0 N--CA 1.478 0.966 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 003 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.05 -29.13 72.39 Favored Glycine 0 C--N 1.343 0.929 0 O-C-N 123.996 0.81 . . . . 0.0 112.592 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -84.01 -31.89 25.21 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD11 HD23 ' A' ' 51' ' ' LEU . 2.4 tm? -65.16 -42.29 93.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.322 1.049 . . . . 0.0 109.059 172.005 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -62.88 -43.57 98.44 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.1 1.36 . . . . 0.0 109.444 173.601 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.1 tm0? -60.81 -44.12 97.29 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.006 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.417 ' O ' HG23 ' A' ' 27' ' ' VAL . 27.7 tpt180 -68.47 -43.29 77.28 Favored 'General case' 0 C--N 1.347 0.483 0 O-C-N 123.685 0.616 . . . . 0.0 111.141 -177.109 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 84.7 mt -57.07 -50.33 76.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.88 -32.5 74.04 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.503 0.721 . . . . 0.0 111.29 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 20.2 tp60 -68.93 -45.27 71.22 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 123.003 0.521 . . . . 0.0 110.1 -179.708 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 23' ' ' ARG . 80.5 t -62.06 -36.79 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.386 0.674 . . . . 0.0 110.303 177.471 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 96.2 mt -66.14 -39.91 90.2 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.552 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 62.6 m -72.03 -48.6 43.36 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.328 1.051 . . . . 0.0 111.984 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.8 mm-40 -68.65 -34.85 76.43 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 118.085 0.402 . . . . 0.0 111.141 -175.251 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.07 -39.36 90.02 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.351 170.628 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.12 23.03 59.09 Favored Glycine 0 C--N 1.356 1.659 0 O-C-N 123.86 0.725 . . . . 0.0 112.321 -174.401 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -153.43 150.15 22.91 Favored Pre-proline 0 C--O 1.24 0.569 0 C-N-CA 124.574 1.15 . . . . 0.0 108.346 -169.398 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.594 ' HB3' ' SG ' ' A' ' 73' ' ' CYS . 6.1 Cg_endo -48.53 112.77 0.67 Allowed 'Trans proline' 0 C--N 1.375 1.969 0 C-N-CA 123.804 3.002 . . . . 0.0 113.026 175.918 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 85.4 t -96.82 136.72 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -77.53 155.93 31.29 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.462 ' O ' HG23 ' A' ' 41' ' ' VAL . 23.0 tp -64.27 -46.23 84.58 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.045 0.938 . . . . 0.0 109.122 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.31 -44.37 33.87 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 0.0 112.48 168.389 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.69 -32.34 65.71 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 117.953 0.342 . . . . 0.0 110.363 179.001 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.6 mt -62.15 -35.63 79.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.849 0.459 . . . . 0.0 110.198 176.76 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 37' ' ' LEU . 61.2 t -56.06 -54.7 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.353 0.661 . . . . 0.0 111.563 177.261 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -71.98 -45.81 59.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.527 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.44 -39.62 94.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 68.5 m -82.24 -18.54 42.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 119.242 -0.408 . . . . 0.0 111.426 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 59.11 31.55 21.39 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.831 0.852 . . . . 0.0 109.905 -173.048 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.28 146.79 45.5 Favored Pre-proline 0 C--O 1.241 0.642 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.239 -169.038 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -63.76 129.41 24.74 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 122.802 2.335 . . . . 0.0 112.391 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -51.78 -28.67 16.16 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 124.341 1.026 . . . . 0.0 112.925 177.588 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.3 mtm180 -53.96 -57.03 12.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.525 0.73 . . . . 0.0 110.392 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.423 ' O ' HG23 ' A' ' 54' ' ' VAL . 1.1 mp0 -66.75 -44.45 81.47 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.768 -175.705 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.482 HD23 HD11 ' A' ' 20' ' ' LEU . 92.2 mt -55.71 -56.38 21.08 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 124.208 0.942 . . . . 0.0 110.401 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -48.7 -53.11 20.11 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.798 1.239 . . . . 0.0 111.374 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -52.15 -56.89 11.67 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 124.1 0.96 . . . . 0.0 112.619 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.664 HG12 ' SD ' ' A' ' 58' ' ' MET . 60.7 t -66.68 -35.56 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.001 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.3 mt -52.15 -48.79 64.72 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.479 1.111 . . . . 0.0 113.262 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -73.88 -25.18 59.9 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 118.253 0.479 . . . . 0.0 110.782 -175.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -67.59 -52.28 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.587 0.755 . . . . 0.0 109.418 172.309 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.664 ' SD ' HG12 ' A' ' 54' ' ' VAL . 70.7 mtp -59.74 -26.58 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.489 1.116 . . . . 0.0 111.368 176.007 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -70.99 -37.2 72.71 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.777 0.431 . . . . 0.0 110.167 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.31 -30.67 68.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.088 0.555 . . . . 0.0 110.412 173.247 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -77.62 -5.66 51.09 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.267 0.627 . . . . 0.0 111.271 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 55.4 mt 68.13 17.58 9.41 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.884 1.274 . . . . 0.0 111.037 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -81.75 -28.67 33.21 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.889 1.276 . . . . 0.0 111.803 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 32.9 m -130.86 158.8 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.225 0.61 . . . . 0.0 109.665 174.825 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.5 m -143.65 149.45 37.28 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -101.28 108.54 20.21 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.428 HG21 ' SG ' ' A' ' 73' ' ' CYS . 33.7 p -99.04 -32.21 11.39 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.25 0.548 . . . . 0.0 111.093 -176.375 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.564 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 35.8 t -140.22 153.83 69.36 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -43.67 114.18 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.519 0 C-N-CA 123.549 2.833 . . . . 0.0 114.011 175.155 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 59.8 26.89 16.11 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.753 1.221 . . . . 0.0 112.117 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.564 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 41.9 m -130.88 125.33 33.28 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 123.259 0.624 . . . . 0.0 109.516 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -117.44 146.53 43.41 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.023 0.929 . . . . 0.0 109.205 -170.795 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.594 ' SG ' ' HB3' ' A' ' 34' ' ' PRO . 78.4 m -113.68 158.66 20.59 Favored 'General case' 0 C--O 1.25 1.115 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.431 . . . . . . . . 2 2 . 1 . 003 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 33.1 tp -64.97 102.31 0.6 Allowed 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.988 174.04 . . . . . . . . 1 1 . 1 . 003 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.497 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.945 178.331 . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 111.618 0.229 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 004 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.18 -39.34 94.38 Favored Glycine 0 C--N 1.344 1.024 0 O-C-N 123.351 0.407 . . . . 0.0 113.683 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 25.3 m-70 -77.77 -30.95 51.7 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.702 0.401 . . . . 0.0 110.209 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.536 HD22 ' SG ' ' A' ' 44' ' ' CYS . 3.0 tm? -60.92 -46.99 88.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.839 1.256 . . . . 0.0 109.529 173.419 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.672 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 21.0 tt0 -58.19 -51.6 69.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.799 1.24 . . . . 0.0 110.352 177.835 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.0 mt-30 -63.95 -34.66 78.48 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.68 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -68.66 -46.15 69.88 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.078 0.551 . . . . 0.0 112.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.5 mt -59.33 -50.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 122.753 0.421 . . . . 0.0 110.111 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.9 mt -64.87 -31.89 73.33 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.317 0.647 . . . . 0.0 110.636 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.474 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 31.7 tt0 -68.68 -47.95 65.17 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.103 0.561 . . . . 0.0 110.14 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.58 -36.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.246 1.018 . . . . 0.0 110.848 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 89.1 mt -67.48 -40.29 85.28 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.644 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 53.1 m -66.12 -48.04 72.15 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.015 0.926 . . . . 0.0 111.428 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 21.9 mm-40 -67.91 -38.94 83.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.457 0.703 . . . . 0.0 111.575 -174.471 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.52 96.14 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.877 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.96 28.57 72.21 Favored Glycine 0 C--N 1.351 1.389 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.057 -172.69 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.2 m -153.8 158.55 32.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 124.428 1.091 . . . . 0.0 109.029 -169.223 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -60.49 122.03 10.66 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.219 1.946 . . . . 0.0 112.106 169.982 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.3 t -107.74 130.68 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.432 1.093 . . . . 0.0 108.756 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.601 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.6 mttt -66.81 152.53 45.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 122.966 0.506 . . . . 0.0 110.837 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.498 ' O ' HG23 ' A' ' 41' ' ' VAL . 27.6 tp -59.72 -45.27 92.67 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 123.949 0.781 . . . . 0.0 109.817 174.221 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.33 -42.69 2.28 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.909 1.283 . . . . 0.0 113.818 168.303 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -84.68 -29.79 25.34 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.64 -33.03 74.2 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.728 0.411 . . . . 0.0 110.201 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.512 ' HA ' HD11 ' A' ' 51' ' ' LEU . 42.8 t -59.46 -55.15 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.56 0.744 . . . . 0.0 111.716 175.442 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -71.93 -39.58 69.35 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.456 -174.777 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -67.32 -50.53 59.71 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.947 0.499 . . . . 0.0 111.92 177.302 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.536 ' SG ' HD22 ' A' ' 20' ' ' LEU . 10.0 t -79.11 -12.85 60.01 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.842 0.457 . . . . 0.0 110.911 -175.584 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 61.78 28.97 17.84 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.818 1.247 . . . . 0.0 111.868 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -122.14 155.59 61.16 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 123.953 0.901 . . . . 0.0 111.367 -172.651 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.64 129.44 23.63 Favored 'Trans proline' 0 C--N 1.381 2.28 0 C-N-CA 122.169 1.912 . . . . 0.0 111.548 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.528 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.9 ttmt -45.26 -41.01 8.09 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 124.722 1.209 . . . . 0.0 113.027 175.961 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -54.14 -46.92 72.35 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.269 1.027 . . . . 0.0 112.031 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -66.5 -43.49 85.16 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.652 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 48' ' ' LYS . 85.2 mt -56.83 -52.02 66.71 Favored 'General case' 0 C--N 1.358 0.974 0 O-C-N 124.227 0.954 . . . . 0.0 111.252 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -48.47 -55.89 9.73 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.625 1.17 . . . . 0.0 111.966 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -60.56 -41.6 94.89 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.79 -174.89 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.4 t -69.56 -44.11 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 122.497 0.319 . . . . 0.0 110.299 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.401 HD13 ' NE1' ' A' ' 72' ' ' TRP . 35.4 mt -50.68 -49.49 57.21 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.917 1.287 . . . . 0.0 113.254 178.857 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.428 ' O ' ' HG2' ' A' ' 60' ' ' LYS . 69.1 m-85 -70.4 -27.55 64.38 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 119.038 0.835 . . . . 0.0 111.33 -177.001 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -72.26 -44.74 62.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.333 0.653 . . . . 0.0 109.496 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.672 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 71.5 mtm -64.49 -31.12 72.19 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.54 0.736 . . . . 0.0 111.217 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -66.61 -35.19 79.6 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.17 0.988 . . . . 0.0 110.974 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 56' ' ' TYR . 74.3 mmtt -57.51 -36.8 72.02 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.493 0.717 . . . . 0.0 111.14 170.932 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -90.55 5.1 49.2 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.321 1.048 . . . . 0.0 111.174 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 61.26 20.37 10.97 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.484 1.514 . . . . 0.0 112.798 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 95.2 mttt -70.68 -38.96 73.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.703 0.801 . . . . 0.0 110.637 176.422 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.5 m -125.04 154.21 32.89 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 C-N-CA 123.778 0.831 . . . . 0.0 109.356 175.163 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -138.88 143.88 38.94 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.405 1.082 . . . . 0.0 108.594 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.22 105.14 17.25 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -173.548 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.8 p -87.25 -36.92 17.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.706 0.802 . . . . 0.0 111.578 -173.635 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.541 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 27.7 m -137.14 163.79 46.68 Favored Pre-proline 0 CA--C 1.551 0.986 0 CA-C-O 117.526 -1.226 . . . . 0.0 107.709 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.414 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 25.6 Cg_exo -20.37 -63.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.399 3.205 1 C-N-CA 125.967 4.445 . . . . 0.0 116.785 -176.265 . . . . . . . . 3 3 . 1 . 004 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.77 10.39 8.97 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.228 0.611 . . . . 0.0 112.061 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.601 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 26.5 m -85.41 126.95 34.19 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.87 0.366 . . . . 0.0 110.562 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.401 ' NE1' HD13 ' A' ' 55' ' ' LEU . 90.7 m95 -108.15 166.17 10.94 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.549 1.14 . . . . 0.0 109.402 -177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 47.4 t -150.17 157.22 42.87 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.585 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 29.3 tp -79.31 112.76 16.86 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.871 0 O-C-N 123.816 0.698 . . . . 0.0 112.336 176.3 . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 . . . . . . . . . 0 0 . 1 . 005 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.35 -27.88 73.35 Favored Glycine 0 N--CA 1.472 1.056 0 O-C-N 123.419 0.449 . . . . 0.0 114.008 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -75.74 -38.0 58.85 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.617 0.767 . . . . 0.0 110.288 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD12 HG21 ' A' ' 54' ' ' VAL . 2.6 tm? -64.3 -41.63 96.77 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.058 0.943 . . . . 0.0 109.976 175.154 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 43.0 tt0 -63.52 -40.61 97.49 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.123 0.969 . . . . 0.0 110.422 173.785 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.52 -36.97 84.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.9 177.544 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.439 ' O ' HG23 ' A' ' 27' ' ' VAL . 1.3 mmp_? -62.07 -50.4 72.11 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.193 0.597 . . . . 0.0 110.961 172.937 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.2 mt -56.64 -47.97 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.024 0.828 . . . . 0.0 110.442 -176.561 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.605 HD21 ' HB3' ' A' ' 63' ' ' LYS . 78.1 mt -60.54 -46.81 88.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.515 0.726 . . . . 0.0 111.57 178.997 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -66.21 -43.18 87.45 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 123.668 0.605 . . . . 0.0 111.116 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 23' ' ' ARG . 70.9 t -61.02 -46.27 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.443 0.697 . . . . 0.0 110.163 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.46 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.8 mt -66.81 -29.74 69.75 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.677 -179.332 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.506 ' HA ' HD22 ' A' ' 74' ' ' LEU . 89.3 m -72.33 -49.77 31.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.717 0.807 . . . . 0.0 111.725 176.632 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.81 -32.25 72.68 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.107 0.563 . . . . 0.0 110.992 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.75 -41.17 88.22 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.312 0.645 . . . . 0.0 110.89 169.311 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.45 23.35 64.6 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.941 -172.869 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -158.57 158.73 29.69 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 125.221 1.408 . . . . 0.0 109.091 -167.745 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 73' ' ' CYS . 19.4 Cg_endo -60.34 128.32 25.81 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.512 2.141 . . . . 0.0 112.253 172.94 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.8 t -106.54 140.07 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 124.425 1.09 . . . . 0.0 108.201 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -74.46 157.97 34.65 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 123.5 0.72 . . . . 0.0 110.854 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 34.3 tp -68.13 -44.9 75.05 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.355 1.062 . . . . 0.0 111.068 -174.114 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.12 -34.83 10.42 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 168.969 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.482 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 49.6 tt0 -85.91 -29.45 23.62 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.93 -25.95 68.37 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.677 0.391 . . . . 0.0 110.331 176.309 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.659 ' HA ' HD11 ' A' ' 51' ' ' LEU . 60.0 t -64.22 -51.43 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 122.991 0.516 . . . . 0.0 110.474 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -74.95 -47.16 30.9 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.603 0.565 . . . . 0.0 111.612 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.482 ' HG2' ' HG2' ' A' ' 39' ' ' GLN . 46.5 mm-40 -61.54 -49.41 76.82 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 59.1 m -82.1 -8.96 59.68 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 56.92 46.55 19.39 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.698 1.199 . . . . 0.0 111.955 176.94 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.36 146.8 26.28 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.778 178.543 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -54.72 150.04 38.01 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.116 2.544 . . . . 0.0 112.998 172.46 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.494 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.1 ttmt -50.29 -34.67 24.32 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.86 1.264 . . . . 0.0 111.99 175.834 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -53.29 -48.93 67.95 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.166 0.987 . . . . 0.0 112.009 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -66.25 -47.05 75.01 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.46 177.718 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.659 HD11 ' HA ' ' A' ' 41' ' ' VAL . 41.9 mt -59.84 -58.83 6.85 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.572 -173.549 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -52.66 -52.86 53.9 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 124.632 1.207 . . . . 0.0 112.074 -174.635 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.18 -37.07 76.48 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.028 0.83 . . . . 0.0 111.614 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.482 HG21 HD12 ' A' ' 20' ' ' LEU . 87.9 t -73.09 -41.98 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 173.351 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.7 -37.21 78.21 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.405 1.082 . . . . 0.0 113.693 -175.7 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -73.21 -27.64 61.73 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 118.652 0.66 . . . . 0.0 110.691 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.408 HH21 ' CD ' ' A' ' 21' ' ' GLU . 4.1 ptt180 -70.79 -44.97 65.53 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.201 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.476 ' HB3' ' HB2' ' A' ' 63' ' ' LYS . 92.6 mtp -66.88 -37.88 85.25 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 124.419 1.088 . . . . 0.0 111.116 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.4 -38.62 90.51 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.678 0.391 . . . . 0.0 110.338 178.599 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.97 -27.63 67.61 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.663 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -91.33 8.73 34.67 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.983 0.913 . . . . 0.0 112.39 176.954 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 63.44 17.16 10.12 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 123.806 0.842 . . . . 0.0 112.263 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.605 ' HB3' HD21 ' A' ' 25' ' ' LEU . 98.3 mttt -82.27 -34.91 28.54 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 124.124 0.97 . . . . 0.0 111.4 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.439 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 18.8 m -132.85 162.53 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.227 0.611 . . . . 0.0 109.997 176.845 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.6 m -131.06 142.95 50.34 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.411 0.684 . . . . 0.0 109.543 175.619 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 41.8 tp -92.51 101.08 13.52 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 175.755 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 31.9 p -85.13 -37.25 20.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.835 0.854 . . . . 0.0 111.667 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.513 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 15.9 t -140.32 155.1 70.3 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_exo -26.84 -59.51 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.52 1 C-N-CA 125.356 4.037 . . . . 0.0 116.865 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -120.05 42.06 3.03 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 111.178 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.513 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 34.1 m -131.95 126.7 34.69 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 123.239 0.616 . . . . 0.0 109.657 174.969 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -120.87 140.77 51.33 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.228 1.011 . . . . 0.0 109.064 -172.842 . . . . . . . . 1 1 . 1 . 005 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 50.8 t -117.9 162.74 17.63 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 123.833 0.853 . . . . 0.0 110.168 -175.962 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 29' ' ' THR . 41.3 tp -69.78 105.69 2.85 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 172.6 . . . . . . . . 2 2 . 1 . 005 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.439 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . . . . . . 0 C--N 1.335 0.502 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 171.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 . . . . . . . . . 0 0 . 1 . 006 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.09 -36.84 94.01 Favored Glycine 0 C--N 1.348 1.224 0 N-CA-C 113.747 0.259 . . . . 0.0 113.747 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -71.58 -39.26 70.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.68 0.392 . . . . 0.0 110.287 177.237 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 51' ' ' LEU . 2.0 tm? -63.24 -46.5 86.64 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.758 1.223 . . . . 0.0 109.566 177.625 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.51 -47.18 82.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.624 1.169 . . . . 0.0 110.306 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -63.21 -39.04 93.5 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.454 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.458 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -64.59 -43.27 94.35 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.0 0.52 . . . . 0.0 110.237 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 20' ' ' LEU . 87.5 mt -58.43 -52.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 123.977 0.798 . . . . 0.0 110.076 177.04 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' A' ' 63' ' ' LYS . 96.0 mt -56.8 -38.45 72.58 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.599 0.76 . . . . 0.0 111.01 -178.058 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -65.17 -48.91 71.83 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.316 1.01 . . . . 0.0 110.99 -178.885 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 23' ' ' ARG . 93.5 t -57.55 -41.71 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.596 0.758 . . . . 0.0 110.825 177.999 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 85.4 mt -63.95 -38.92 92.84 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.953 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.2 m -69.69 -46.12 66.76 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 123.616 0.766 . . . . 0.0 111.495 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.19 -38.31 90.65 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.527 0.731 . . . . 0.0 110.942 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.38 -44.19 83.78 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.509 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 20.19 66.89 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.194 -173.053 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 54.9 p -159.92 153.79 19.48 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.915 1.286 . . . . 0.0 109.155 -168.647 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.48 123.53 9.38 Favored 'Trans proline' 0 C--N 1.378 2.114 0 C-N-CA 123.65 2.9 . . . . 0.0 114.155 -178.368 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.3 t -108.51 129.73 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 124.626 1.171 . . . . 0.0 108.611 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 61.0 mttp -70.52 153.55 42.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.994 0.518 . . . . 0.0 110.66 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.474 ' O ' HG23 ' A' ' 41' ' ' VAL . 53.5 tp -59.76 -48.11 83.0 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 123.885 0.74 . . . . 0.0 109.993 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.31 -41.64 19.56 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.576 1.15 . . . . 0.0 113.071 170.146 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 53.4 tt0 -73.29 -37.68 66.14 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 122.933 0.493 . . . . 0.0 110.734 178.752 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.41 -34.97 73.11 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.361 0.664 . . . . 0.0 110.466 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 37' ' ' LEU . 35.9 t -56.88 -56.64 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.642 0.777 . . . . 0.0 111.711 176.365 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -69.29 -37.96 78.08 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 123.726 0.641 . . . . 0.0 111.735 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 29.7 mm-40 -63.75 -55.82 20.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.098 0.559 . . . . 0.0 111.911 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 41.8 t -76.95 -18.43 58.25 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 122.778 0.431 . . . . 0.0 110.792 -174.457 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 62.21 23.78 14.1 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.942 1.297 . . . . 0.0 110.996 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.19 153.15 49.77 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.554 1.142 . . . . 0.0 109.829 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.487 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 10.5 Cg_endo -54.37 131.16 43.72 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.032 2.488 . . . . 0.0 112.45 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -42.51 -44.89 4.28 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.168 1.387 . . . . 0.0 113.488 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.412 ' HG3' ' N ' ' A' ' 50' ' ' GLU . 47.7 ptt85 -57.66 -39.93 78.16 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 123.765 0.666 . . . . 0.0 111.829 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.487 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 6.2 tp10 -66.53 -49.38 66.69 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 123.566 0.746 . . . . 0.0 109.933 -178.568 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.585 ' HA ' HD11 ' A' ' 20' ' ' LEU . 22.3 mt -58.56 -57.21 13.95 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.666 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.464 ' HA ' HD12 ' A' ' 55' ' ' LEU . 22.0 t-20 -50.47 -53.74 27.43 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.697 1.599 . . . . 0.0 112.402 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -58.0 -49.39 77.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.248 0.619 . . . . 0.0 111.702 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.483 HG12 ' SD ' ' A' ' 58' ' ' MET . 70.3 t -63.91 -37.57 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.383 0.673 . . . . 0.0 110.675 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 52' ' ' ASN . 32.1 mt -54.08 -35.2 61.82 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.441 1.096 . . . . 0.0 112.751 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -69.93 -34.55 73.61 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.466 0.576 . . . . 0.0 111.782 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -66.7 -49.25 66.68 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.483 ' SD ' HG12 ' A' ' 54' ' ' VAL . 72.4 mtp -62.0 -36.01 80.23 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.263 1.025 . . . . 0.0 111.335 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -64.44 -39.58 94.09 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.943 0.897 . . . . 0.0 111.78 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -67.72 -25.94 65.91 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.316 0.646 . . . . 0.0 111.453 175.559 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -89.53 4.74 48.3 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.56 0.744 . . . . 0.0 110.616 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 62.18 13.61 5.98 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.136 1.375 . . . . 0.0 112.642 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.543 ' HB3' HD21 ' A' ' 25' ' ' LEU . 94.5 mttt -66.5 -39.45 88.71 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.352 1.061 . . . . 0.0 110.431 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.1 m -125.47 160.78 31.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-N 114.856 -1.065 . . . . 0.0 108.9 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.57 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 70.8 m -137.68 143.82 41.5 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.995 0.918 . . . . 0.0 108.705 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.6 101.0 12.54 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 t -92.94 -33.68 14.08 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.014 -171.646 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.679 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 18.5 m -139.07 162.71 50.76 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.079 0.952 . . . . 0.0 108.717 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.67 111.74 0.77 Allowed 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 122.941 2.428 . . . . 0.0 113.281 178.441 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 63.79 26.37 14.37 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.79 1.236 . . . . 0.0 111.538 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.679 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 87.5 m -130.2 125.6 35.33 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.769 0.828 . . . . 0.0 108.927 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -113.46 171.28 7.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.133 0.973 . . . . 0.0 109.449 -172.102 . . . . . . . . 1 1 . 1 . 006 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.57 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 20.0 p -152.6 160.12 43.21 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.606 0.763 . . . . 0.0 109.008 177.868 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.602 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 26.1 tp -78.05 101.86 7.15 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.806 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.19 . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.772 -0.633 . . . . 0.0 111.738 . . . . . . . . . 0 0 . 1 . 007 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.69 -48.98 73.35 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-O 119.858 -0.412 . . . . 0.0 114.091 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -66.52 -47.34 73.23 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.989 0.515 . . . . 0.0 111.583 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.628 HD12 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -63.36 -40.54 97.55 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.721 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.1 tt0 -61.83 -48.36 80.9 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.572 1.149 . . . . 0.0 110.354 177.737 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -57.76 -41.08 81.2 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.484 0.713 . . . . 0.0 109.928 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.468 ' O ' HG23 ' A' ' 27' ' ' VAL . 20.2 mmm180 -68.28 -44.63 75.12 Favored 'General case' 0 C--N 1.352 0.695 0 C-N-CA 123.541 0.737 . . . . 0.0 112.398 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 53.9 mt -59.83 -50.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.137 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 21' ' ' GLU . 79.4 mt -63.92 -33.45 75.73 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.756 0.66 . . . . 0.0 110.744 -176.703 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -69.09 -43.72 73.93 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.469 0.708 . . . . 0.0 110.594 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 23' ' ' ARG . 72.8 t -62.66 -34.94 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.537 178.199 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 78.3 mt -66.62 -37.34 84.65 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.211 175.214 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -67.37 -52.72 36.65 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 124.193 0.997 . . . . 0.0 111.599 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -69.79 -31.46 69.4 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.102 0.561 . . . . 0.0 111.7 -171.094 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.94 -38.34 90.64 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.751 167.484 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.07 25.3 70.84 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.521 -175.711 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.6 p -161.17 159.75 24.33 Favored Pre-proline 0 C--O 1.245 0.859 0 C-N-CA 125.25 1.42 . . . . 0.0 109.105 -172.421 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.98 126.16 21.31 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.109 1.873 . . . . 0.0 112.773 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 89.3 t -104.03 138.38 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.126 0.97 . . . . 0.0 108.663 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -73.9 152.15 40.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.418 ' O ' HG23 ' A' ' 41' ' ' VAL . 26.2 tp -61.86 -46.51 89.11 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.859 0.863 . . . . 0.0 109.846 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.45 -45.05 3.06 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.902 1.281 . . . . 0.0 112.816 167.13 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.422 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 62.3 tt0 -79.79 -30.55 40.66 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.911 0.484 . . . . 0.0 111.034 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.97 -30.82 71.87 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.161 0.584 . . . . 0.0 110.997 178.269 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.5 ' HA ' HD11 ' A' ' 51' ' ' LEU . 64.4 t -55.75 -56.35 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.692 0.797 . . . . 0.0 112.024 176.887 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.422 ' HE2' ' HG3' ' A' ' 39' ' ' GLN . 63.2 pttt -68.85 -42.44 77.12 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 123.567 0.542 . . . . 0.0 111.668 -175.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -66.92 -49.39 65.68 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.516 0.727 . . . . 0.0 112.089 -177.505 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 56.9 m -81.35 -9.94 59.64 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 122.376 0.271 . . . . 0.0 110.805 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 60.13 29.49 19.05 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.481 1.112 . . . . 0.0 111.401 175.87 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.7 156.06 65.45 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 123.525 0.73 . . . . 0.0 111.003 -173.844 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.62 133.0 32.67 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.644 2.229 . . . . 0.0 111.938 174.275 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -46.97 -36.69 8.01 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.959 1.303 . . . . 0.0 113.072 174.91 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.0 mtm180 -54.6 -49.09 71.27 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.665 0.786 . . . . 0.0 110.957 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -67.15 -46.96 72.49 Favored 'General case' 0 C--O 1.25 1.126 0 C-N-CA 123.891 0.876 . . . . 0.0 110.659 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.507 HD23 HD11 ' A' ' 20' ' ' LEU . 95.9 mt -53.68 -51.74 62.25 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.997 0.919 . . . . 0.0 111.496 -176.811 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -53.47 -50.99 64.15 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 124.621 1.201 . . . . 0.0 112.444 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -57.07 -39.88 75.81 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.993 0.808 . . . . 0.0 111.269 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.628 HG21 HD12 ' A' ' 20' ' ' LEU . 98.2 t -71.49 -43.79 71.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.567 0.747 . . . . 0.0 110.993 176.098 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.455 HD13 ' NE1' ' A' ' 72' ' ' TRP . 79.6 mt -54.04 -45.05 71.53 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.474 1.109 . . . . 0.0 113.368 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.78 -25.4 59.04 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.112 0.414 . . . . 0.0 111.534 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -68.37 -53.52 23.4 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.721 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 68.7 mtm -60.79 -31.86 71.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.995 0.918 . . . . 0.0 110.987 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -62.62 -46.81 86.55 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.828 0.851 . . . . 0.0 110.861 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 60' ' ' LYS . 4.9 ttmp? -68.18 -26.11 65.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.443 0.697 . . . . 0.0 111.418 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -90.4 -0.0 57.46 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.314 0.646 . . . . 0.0 111.516 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 67.75 10.99 8.16 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 124.928 1.291 . . . . 0.0 112.845 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.532 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.1 mttt -69.51 -28.24 65.88 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.656 0.783 . . . . 0.0 111.04 174.285 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.0 161.23 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.544 0.738 . . . . 0.0 110.048 171.822 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.7 m -139.08 152.21 47.34 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.75 0.82 . . . . 0.0 108.876 172.814 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.7 tp -101.25 106.96 18.22 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.2 p -92.97 -39.79 10.92 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.636 0.775 . . . . 0.0 111.178 -175.063 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.509 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 25.3 m -140.68 167.04 18.97 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 123.854 0.861 . . . . 0.0 109.249 -173.879 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.71 112.43 0.69 Allowed 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 123.124 2.549 . . . . 0.0 113.429 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 62.63 18.96 10.98 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.372 1.069 . . . . 0.0 112.856 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.509 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 31.4 m -119.78 123.17 43.07 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 123.574 0.75 . . . . 0.0 110.0 -174.506 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.455 ' NE1' HD13 ' A' ' 55' ' ' LEU . 62.5 m95 -119.32 151.63 38.12 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.339 1.055 . . . . 0.0 109.614 -169.841 . . . . . . . . 2 2 . 1 . 007 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 24.4 p -128.22 157.03 41.98 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 109.337 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 46.3 tp -77.61 131.19 37.68 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.937 0.495 . . . . 0.0 110.839 -178.558 . . . . . . . . 1 1 . 1 . 007 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 1.281 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 171.69 . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 . . . . . . . . . 0 0 . 1 . 008 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.32 -38.86 96.94 Favored Glycine 0 C--N 1.342 0.878 0 O-C-N 123.392 0.433 . . . . 0.0 113.012 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.5 m-70 -73.43 -36.21 65.9 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.191 0.52 . . . . 0.0 110.52 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.523 HD12 HG21 ' A' ' 54' ' ' VAL . 2.0 tm? -65.82 -42.53 90.49 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.304 1.042 . . . . 0.0 110.148 174.631 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -61.35 -42.8 99.28 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.787 0.835 . . . . 0.0 109.898 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -42.54 93.92 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.948 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.438 ' O ' HG23 ' A' ' 27' ' ' VAL . 12.7 tpt180 -67.16 -42.27 84.59 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.137 -177.791 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 78.5 mt -57.01 -49.61 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 O-C-N 123.909 0.756 . . . . 0.0 109.876 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 63' ' ' LYS . 92.0 mt -59.24 -39.59 83.25 Favored 'General case' 0 C--N 1.349 0.547 0 O-C-N 123.987 0.804 . . . . 0.0 111.142 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -66.62 -45.44 79.1 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.667 0.605 . . . . 0.0 110.911 -176.777 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 23' ' ' ARG . 86.6 t -56.34 -42.83 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.289 0.636 . . . . 0.0 110.279 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 97.8 mt -71.9 -34.59 69.25 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.635 -177.906 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.45 ' HA ' HD22 ' A' ' 74' ' ' LEU . 27.3 m -70.63 -45.65 64.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.314 0.646 . . . . 0.0 111.68 179.518 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.1 -33.17 74.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.913 0.485 . . . . 0.0 110.867 -177.239 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.68 -44.88 66.11 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.705 0.628 . . . . 0.0 110.345 172.024 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.42 25.52 67.0 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.782 -170.245 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.7 m -148.41 155.29 42.46 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 124.082 0.953 . . . . 0.0 110.314 -166.999 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -60.53 109.21 0.61 Allowed 'Trans proline' 0 C--N 1.368 1.564 0 C-N-CA 123.063 2.509 . . . . 0.0 112.089 169.567 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.5 t -97.12 130.65 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.991 0.916 . . . . 0.0 108.531 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.64 153.29 43.64 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 41' ' ' VAL . 36.1 tp -59.18 -45.46 90.99 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.991 0.807 . . . . 0.0 110.23 -178.276 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.58 -47.27 10.29 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.362 1.065 . . . . 0.0 112.94 170.213 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.436 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.9 tt0 -77.32 -34.89 55.27 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.002 0.521 . . . . 0.0 110.397 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.8 mt -56.76 -41.51 77.72 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.618 0.767 . . . . 0.0 110.591 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 37' ' ' LEU . 92.1 t -53.59 -56.34 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 124.243 0.965 . . . . 0.0 111.635 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -74.59 -35.18 62.99 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.27 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 13.7 mm-40 -69.98 -45.86 66.44 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 122.713 0.405 . . . . 0.0 112.088 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.589 ' SG ' ' HB3' ' A' ' 46' ' ' ALA . 23.8 p -72.6 -19.66 61.43 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.399 0.279 . . . . 0.0 111.042 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 64.8 37.84 7.1 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 124.292 1.037 . . . . 0.0 110.106 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.589 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -134.64 159.45 72.16 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.679 -173.213 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.71 134.81 22.68 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.426 2.084 . . . . 0.0 111.95 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -50.21 -31.84 14.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.669 1.188 . . . . 0.0 113.086 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -61.03 -48.64 80.84 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 122.622 0.369 . . . . 0.0 111.183 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -65.86 -46.61 77.8 Favored 'General case' 0 C--O 1.242 0.691 0 O-C-N 123.772 0.67 . . . . 0.0 110.55 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.569 HD21 ' SG ' ' A' ' 44' ' ' CYS . 93.8 mt -55.06 -58.61 6.95 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 124.267 0.98 . . . . 0.0 110.746 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -48.13 -53.24 17.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.658 1.583 . . . . 0.0 112.216 -174.497 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -56.52 -48.83 76.4 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 123.945 0.778 . . . . 0.0 112.423 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.585 HG12 ' SD ' ' A' ' 58' ' ' MET . 70.1 t -63.63 -43.73 98.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 123.734 0.647 . . . . 0.0 110.726 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 77.0 mt -50.7 -43.9 57.9 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.237 1.415 . . . . 0.0 113.739 -177.335 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.459 ' O ' ' HG3' ' A' ' 60' ' ' LYS . 92.5 m-85 -73.1 -30.92 64.0 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.508 0.595 . . . . 0.0 112.21 -178.985 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.4 ttt85 -74.02 -51.99 14.13 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.443 0.297 . . . . 0.0 110.209 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.585 ' SD ' HG12 ' A' ' 54' ' ' VAL . 19.7 ptm -65.82 -19.26 65.82 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.137 0.575 . . . . 0.0 110.812 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -65.46 -44.31 87.6 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.555 0.742 . . . . 0.0 110.759 171.49 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 56' ' ' TYR . 61.3 mttm -66.35 -31.68 72.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.637 0.775 . . . . 0.0 110.826 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -84.45 6.24 24.19 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.227 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.81 10.93 7.24 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.872 1.269 . . . . 0.0 112.305 176.441 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.602 ' HB3' HD21 ' A' ' 25' ' ' LEU . 92.3 mttt -70.85 -34.97 72.19 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.586 0.754 . . . . 0.0 110.505 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.509 HG22 ' HG3' ' A' ' 58' ' ' MET . 16.4 m -133.64 160.33 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.289 0.635 . . . . 0.0 109.731 174.409 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.1 m -125.45 150.6 47.17 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.5 tp -104.49 104.67 14.56 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.1 p -87.73 -42.75 12.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.73 0.812 . . . . 0.0 110.896 -172.654 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.502 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 30.7 m -139.84 170.63 9.41 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.035 0.934 . . . . 0.0 109.486 -174.476 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.32 106.49 0.08 OUTLIER 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 123.418 2.746 . . . . 0.0 114.071 173.714 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.04 20.0 10.46 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.765 1.226 . . . . 0.0 112.626 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.502 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 34.6 m -114.64 118.47 33.76 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.61 0.764 . . . . 0.0 109.153 -174.84 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 58.3 m95 -116.92 139.15 50.98 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.948 0.899 . . . . 0.0 109.314 -169.572 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 45.8 t -117.38 165.08 13.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.029 0.532 . . . . 0.0 109.902 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 29' ' ' THR . 45.5 tp -65.93 111.64 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 122.969 0.508 . . . . 0.0 110.112 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.57 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 175.303 . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 009 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.4 99.75 Favored Glycine 0 C--N 1.351 1.378 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -69.21 -45.65 69.36 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -177.231 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.564 HD11 HD23 ' A' ' 51' ' ' LEU . 2.6 tm? -64.69 -37.26 86.98 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.125 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -60.91 -50.85 71.76 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.235 1.014 . . . . 0.0 110.461 175.792 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -62.62 -31.87 72.79 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 124.617 1.198 . . . . 0.0 110.559 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -71.35 -44.11 65.68 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.11 0.564 . . . . 0.0 111.311 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.427 HD12 ' HE3' ' A' ' 58' ' ' MET . 79.5 mt -60.53 -47.41 92.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 177.094 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.67 -36.05 73.54 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.678 0.791 . . . . 0.0 110.66 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -65.45 -48.71 71.78 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.034 0.834 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 71.4 t -58.56 -39.42 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.883 0.873 . . . . 0.0 110.752 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -68.46 -38.89 81.5 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.098 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 67.5 m -72.18 -45.69 59.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.526 0.73 . . . . 0.0 111.991 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.16 -38.76 91.58 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.042 0.537 . . . . 0.0 110.969 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.83 83.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.414 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 67.2 22.53 72.72 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.322 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.1 p -151.39 166.73 14.49 Favored Pre-proline 0 C--O 1.246 0.901 0 C-N-CA 123.999 0.92 . . . . 0.0 109.697 -169.76 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.18 118.51 5.41 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.424 2.083 . . . . 0.0 111.918 171.345 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 99.1 t -102.5 125.29 56.8 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 67.2 mttm -69.52 155.08 41.04 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.981 0.512 . . . . 0.0 110.523 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 41' ' ' VAL . 33.4 tp -61.19 -49.75 75.92 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.419 0.688 . . . . 0.0 110.726 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.83 -38.37 15.81 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.841 0.857 . . . . 0.0 112.578 171.439 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.465 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 62.5 tt0 -75.36 -38.88 59.81 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 122.795 0.438 . . . . 0.0 110.574 176.785 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.8 mt -56.98 -40.59 76.81 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.422 0.689 . . . . 0.0 110.641 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 37' ' ' LEU . 51.7 t -55.22 -54.07 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 123.962 0.789 . . . . 0.0 111.639 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -69.53 -39.01 77.75 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.241 0.338 . . . . 0.0 111.375 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 46.6 mm-40 -64.35 -53.67 45.06 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.631 ' SG ' HD21 ' A' ' 51' ' ' LEU . 31.6 p -76.92 -24.45 52.44 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 122.721 0.408 . . . . 0.0 111.132 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 63.3 36.61 11.6 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.107 0.963 . . . . 0.0 110.919 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.429 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -118.81 150.47 48.51 Favored Pre-proline 0 C--O 1.242 0.697 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.394 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.08 135.84 45.5 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.207 1.938 . . . . 0.0 111.437 177.52 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -50.02 -33.28 17.58 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.683 1.193 . . . . 0.0 112.64 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -61.54 -45.06 95.77 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.581 0.752 . . . . 0.0 111.74 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -65.0 -50.16 67.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.618 0.767 . . . . 0.0 110.387 174.173 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.631 HD21 ' SG ' ' A' ' 44' ' ' CYS . 97.0 mt -53.95 -58.89 5.63 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 124.201 1.0 . . . . 0.0 112.01 -176.896 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.453 ' HA ' HD12 ' A' ' 55' ' ' LEU . 5.3 m-20 -55.7 -46.43 77.68 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.554 1.159 . . . . 0.0 111.953 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -54.08 -48.82 70.25 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 123.853 0.721 . . . . 0.0 110.691 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.486 HG21 HD12 ' A' ' 20' ' ' LEU . 56.9 t -70.15 -36.08 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.101 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' A' ' 52' ' ' ASN . 57.7 mt -53.55 -42.92 68.01 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.437 1.095 . . . . 0.0 113.649 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -72.62 -27.17 61.99 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 118.681 0.673 . . . . 0.0 111.405 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -67.35 -58.58 4.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.662 0.785 . . . . 0.0 110.473 176.01 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.545 ' SD ' HG11 ' A' ' 64' ' ' VAL . 14.4 ptp -61.56 -28.73 69.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.724 0.81 . . . . 0.0 111.561 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -65.89 -43.71 87.46 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 0.0 110.963 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.425 ' NZ ' ' HB2' ' A' ' 60' ' ' LYS . 5.0 ttmp? -63.35 -39.24 94.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.716 0.806 . . . . 0.0 111.008 174.638 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -82.78 4.15 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.231 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.6 mt 63.03 15.04 8.11 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.365 1.466 . . . . 0.0 112.553 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.72 -23.15 60.81 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 124.411 1.084 . . . . 0.0 110.433 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.545 HG11 ' SD ' ' A' ' 58' ' ' MET . 13.3 m -130.52 170.09 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.115 0.566 . . . . 0.0 109.933 171.386 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.8 t -135.0 153.37 52.11 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.345 173.277 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.0 tp -101.25 101.82 12.58 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 176.148 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.4 p -81.52 -41.68 21.34 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.965 0.506 . . . . 0.0 110.444 -176.165 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.544 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 42.3 t -140.21 152.3 66.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.644 0.778 . . . . 0.0 108.915 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.16 124.37 8.9 Favored 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.135 2.557 . . . . 0.0 112.431 168.378 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 69.31 9.53 7.36 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.155 1.382 . . . . 0.0 112.715 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.544 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 58.3 m -129.02 120.04 25.32 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.64 0.776 . . . . 0.0 109.264 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -107.15 166.81 10.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.732 0.813 . . . . 0.0 108.867 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.3 t -152.82 165.13 36.35 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.3 tp -71.12 148.39 47.47 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.14 0 O-C-N 123.497 0.498 . . . . 0.0 112.256 -179.342 . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 . . . . . . . . . 0 0 . 1 . 010 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.41 74.26 Favored Glycine 0 C--N 1.345 1.058 0 O-C-N 123.971 0.794 . . . . 0.0 114.709 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -75.99 -38.68 57.12 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.186 0.594 . . . . 0.0 109.78 177.049 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.599 HD12 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -64.54 -43.64 93.34 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.712 176.529 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -65.55 -40.39 92.79 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.272 1.029 . . . . 0.0 110.043 176.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.0 -38.09 87.3 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.738 0.815 . . . . 0.0 110.223 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 27' ' ' VAL . 22.8 mmm180 -63.76 -50.83 67.5 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 122.737 0.415 . . . . 0.0 110.919 174.865 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.43 HG21 HD21 ' A' ' 55' ' ' LEU . 87.8 mt -56.1 -54.23 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 O-C-N 123.863 0.727 . . . . 0.0 110.354 -175.641 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 63' ' ' LYS . 90.0 mt -65.01 -35.43 81.17 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.953 0.901 . . . . 0.0 111.486 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -66.09 -47.4 74.33 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.296 0.638 . . . . 0.0 110.328 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 23' ' ' ARG . 61.1 t -59.81 -40.9 83.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 124.516 1.126 . . . . 0.0 111.205 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.57 -38.65 87.52 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.742 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 73.5 m -68.73 -50.46 50.53 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.121 0.968 . . . . 0.0 111.776 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -67.44 -40.46 85.44 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.97 0.508 . . . . 0.0 110.994 -173.813 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -42.19 98.8 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.386 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.76 29.4 64.4 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 115.164 -0.926 . . . . 0.0 112.249 -174.779 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.2 m -150.94 153.89 33.71 Favored Pre-proline 0 C--O 1.242 0.665 0 C-N-CA 125.296 1.438 . . . . 0.0 107.897 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -60.98 114.05 2.0 Allowed 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.194 1.929 . . . . 0.0 111.382 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.7 t -96.23 128.21 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.357 1.063 . . . . 0.0 108.281 -176.284 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 49.0 mtmt -58.58 154.72 13.68 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.447 0.699 . . . . 0.0 111.397 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.5 tp -67.43 -50.74 58.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.017 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -53.67 -28.1 31.42 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -81.88 -30.64 31.87 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.909 0.484 . . . . 0.0 109.882 177.121 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.36 -26.38 67.24 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.138 0.575 . . . . 0.0 110.087 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.448 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.5 t -58.52 -53.23 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.498 0.719 . . . . 0.0 111.4 174.63 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -70.79 -40.72 72.38 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.887 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -69.46 -51.77 32.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.972 0.509 . . . . 0.0 112.128 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 57.2 m -78.03 -13.22 59.95 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.385 0.274 . . . . 0.0 110.789 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 60.38 31.39 20.36 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.008 1.323 . . . . 0.0 111.891 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.24 154.43 56.13 Favored Pre-proline 0 N--CA 1.473 0.681 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.501 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.444 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 11.4 Cg_endo -56.12 136.72 76.56 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.81 2.34 . . . . 0.0 111.632 169.999 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.414 ' HA ' HD12 ' A' ' 51' ' ' LEU . 26.0 ttpp -48.96 -41.5 34.32 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.196 0.998 . . . . 0.0 112.225 172.858 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.444 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 21.8 ptt180 -59.0 -37.62 77.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.826 0.45 . . . . 0.0 111.924 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.41 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 23.8 tp10 -66.79 -50.15 63.58 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 123.727 0.811 . . . . 0.0 110.029 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.464 HD23 HD11 ' A' ' 20' ' ' LEU . 76.7 mt -57.22 -50.08 74.0 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.157 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -52.07 -51.54 56.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.465 1.103 . . . . 0.0 111.504 -176.938 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -66.86 -37.06 83.73 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 124.127 0.892 . . . . 0.0 111.524 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.704 HG12 ' SD ' ' A' ' 58' ' ' MET . 95.7 t -66.38 -47.52 83.76 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 24' ' ' ILE . 39.3 mt -57.72 -37.77 74.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.223 1.409 . . . . 0.0 112.888 177.997 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -68.54 -28.64 67.16 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 122.903 0.481 . . . . 0.0 111.413 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -71.54 -53.55 13.44 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 171.358 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.704 ' SD ' HG12 ' A' ' 54' ' ' VAL . 77.9 mtp -61.01 -32.38 71.98 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.971 1.308 . . . . 0.0 113.051 -172.83 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -70.44 -34.16 72.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.366 0.266 . . . . 0.0 111.162 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -71.54 -24.56 61.97 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.377 0.671 . . . . 0.0 110.326 173.085 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.07 5.8 42.79 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.368 1.067 . . . . 0.0 110.718 174.261 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 60.7 14.93 5.39 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.341 1.456 . . . . 0.0 112.775 177.384 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.537 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.3 mttt -73.97 -40.9 62.68 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.214 1.006 . . . . 0.0 110.838 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.1 m -126.45 158.35 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.492 0.717 . . . . 0.0 110.517 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.1 m -135.63 150.27 49.58 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.627 1.171 . . . . 0.0 108.323 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.1 tp -99.96 110.77 23.09 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.5 p -82.54 -46.39 13.44 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 -177.43 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.424 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.4 m -133.21 163.65 49.59 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.311 -1.328 . . . . 0.0 108.18 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 19.3 Cg_exo -25.52 -63.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.393 2.901 1 C-N-CA 125.464 4.109 . . . . 0.0 116.432 -174.913 . . . . . . . . 3 3 . 1 . 010 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.58 53.59 1.74 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.613 0.765 . . . . 0.0 110.508 172.904 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 36.0 m -132.39 120.53 22.15 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 172.379 . . . . . . . . 2 2 . 1 . 010 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -106.21 169.17 8.66 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.449 1.1 . . . . 0.0 109.273 -174.666 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.2 t -151.16 159.96 44.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.656 0.782 . . . . 0.0 109.633 -175.726 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 35.7 tp -72.89 104.3 4.0 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 174.634 . . . . . . . . 1 1 . 1 . 010 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.751 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.64 177.623 . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 011 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -54.42 -41.0 70.89 Favored Glycine 0 C--N 1.351 1.403 0 O-C-N 123.81 0.694 . . . . 0.0 114.37 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -75.76 -40.02 56.07 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.445 0.298 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.484 HD11 HD23 ' A' ' 51' ' ' LEU . 1.5 tm? -60.0 -52.8 63.86 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.817 1.247 . . . . 0.0 110.098 -178.911 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.759 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.8 tt0 -62.19 -44.66 96.1 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.995 1.318 . . . . 0.0 110.513 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -56.91 -44.98 82.93 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.37 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.438 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 0.8 OUTLIER -66.27 -47.7 72.82 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.312 0.645 . . . . 0.0 112.33 -178.793 . . . . . . . . 3 3 . 1 . 011 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.8 mt -60.74 -50.99 78.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 123.589 0.556 . . . . 0.0 110.126 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -64.2 -38.36 90.77 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 111.806 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -71.47 -40.12 70.49 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.747 0.654 . . . . 0.0 110.456 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.4 t -61.89 -39.16 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.144 0.578 . . . . 0.0 110.032 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.42 -29.03 63.34 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.564 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 29' ' ' THR . . . . . 0.481 ' HA ' HD22 ' A' ' 74' ' ' LEU . 86.4 m -75.49 -44.15 45.42 Favored 'General case' 0 C--N 1.353 0.755 0 C-N-CA 123.584 0.754 . . . . 0.0 111.395 176.79 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -70.11 -37.25 75.3 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.498 0.719 . . . . 0.0 110.229 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.33 -39.82 71.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 122.959 0.504 . . . . 0.0 109.7 172.711 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.53 31.5 67.01 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.751 -175.633 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -160.45 149.47 13.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.946 0.899 . . . . 0.0 109.091 -166.671 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -60.77 113.4 1.69 Allowed 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.976 2.451 . . . . 0.0 112.712 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.3 t -102.61 138.61 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.662 1.185 . . . . 0.0 108.208 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.87 149.48 50.53 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.347 0.659 . . . . 0.0 110.588 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 41' ' ' VAL . 25.3 tp -59.37 -49.08 79.19 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.555 1.159 . . . . 0.0 110.953 178.573 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.75 -36.98 17.63 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.107 0.963 . . . . 0.0 113.117 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.524 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 51.2 tt0 -76.66 -34.48 58.25 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.766 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.45 -29.24 69.89 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.288 0.635 . . . . 0.0 110.497 177.417 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.495 ' HA ' HD11 ' A' ' 51' ' ' LEU . 93.9 t -59.8 -53.09 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.839 0.855 . . . . 0.0 111.155 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HE2' ' HG3' ' A' ' 39' ' ' GLN . 63.5 pttt -73.41 -34.73 65.64 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 123.648 0.592 . . . . 0.0 111.487 -177.767 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 26.9 mm-40 -62.04 -55.86 24.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.63 0.372 . . . . 0.0 110.616 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 45.4 t -81.83 -10.82 59.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.674 0.39 . . . . 0.0 110.714 -174.309 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 56.32 32.62 20.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.787 1.235 . . . . 0.0 110.886 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.61 149.72 53.48 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.176 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -61.11 130.93 34.37 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.599 2.199 . . . . 0.0 111.609 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -44.53 -36.29 2.91 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.387 1.475 . . . . 0.0 112.924 172.618 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.264 1.025 . . . . 0.0 111.544 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.08 -39.52 75.56 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.229 0.612 . . . . 0.0 111.061 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 41' ' ' VAL . 93.9 mt -56.66 -52.46 64.82 Favored 'General case' 0 C--N 1.359 1.005 0 O-C-N 123.938 0.774 . . . . 0.0 110.67 175.358 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.8 m-20 -50.54 -51.39 48.27 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 125.137 1.375 . . . . 0.0 111.886 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -50.89 -52.83 37.94 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.336 1.054 . . . . 0.0 112.032 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.39 -37.86 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.471 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.414 HD13 ' NE1' ' A' ' 72' ' ' TRP . 38.8 mt -57.39 -46.02 83.88 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.863 1.265 . . . . 0.0 114.115 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -71.08 -28.76 64.57 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 119.271 0.941 . . . . 0.0 110.908 -178.821 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.43 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.5 tpp85 -66.73 -50.21 63.51 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.164 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.759 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 76.0 mtm -66.68 -27.53 67.73 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 124.109 0.963 . . . . 0.0 112.138 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -67.11 -40.37 86.87 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.583 0.753 . . . . 0.0 109.891 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -71.44 -34.54 70.37 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.873 0.733 . . . . 0.0 110.747 173.263 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 57' ' ' ARG . 51.0 mt-10 -76.69 -5.17 46.87 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.154 0.582 . . . . 0.0 111.197 174.966 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.8 mt 66.04 14.03 9.4 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.783 1.633 . . . . 0.0 112.492 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.541 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.2 mttt -69.65 -35.31 75.06 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 124.374 1.07 . . . . 0.0 110.611 175.218 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.2 m -126.69 152.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 O-C-N 123.907 0.754 . . . . 0.0 109.479 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 45.1 t -119.86 147.39 44.75 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.14 0.976 . . . . 0.0 108.826 176.093 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.6 tp -99.38 101.67 13.02 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.1 p -87.69 -34.15 18.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.677 0.791 . . . . 0.0 111.456 -175.097 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.436 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.7 m -139.42 161.16 58.62 Favored Pre-proline 0 N--CA 1.482 1.142 0 CA-C-O 117.21 -1.376 . . . . 0.0 107.57 176.301 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -25.53 -59.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 125.261 3.974 . . . . 0.0 116.606 -176.175 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -128.83 53.4 1.86 Allowed 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.456 0.646 . . . . 0.0 110.586 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.436 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 70.1 m -130.97 127.88 39.29 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.758 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.414 ' NE1' HD13 ' A' ' 55' ' ' LEU . 81.6 m95 -118.38 137.55 53.04 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.421 0.688 . . . . 0.0 110.468 -171.487 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 49.9 t -116.19 164.3 14.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.949 0.899 . . . . 0.0 109.518 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 29' ' ' THR . 40.9 tp -67.64 108.56 2.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 173.962 . . . . . . . . 2 2 . 1 . 011 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.121 0 O-C-N 123.782 0.676 . . . . 0.0 112.533 176.713 . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 119.056 -0.497 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 012 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.15 -48.84 76.39 Favored Glycine 0 C--N 1.353 1.523 0 O-C-N 123.527 0.517 . . . . 0.0 114.275 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -64.98 -40.5 95.07 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.309 0.576 . . . . 0.0 110.028 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.417 HD12 HG21 ' A' ' 54' ' ' VAL . 2.9 tm? -62.0 -42.72 99.46 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.436 1.495 . . . . 0.0 110.215 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.05 -40.0 95.32 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.334 1.054 . . . . 0.0 110.398 177.64 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.71 -43.16 97.41 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.532 177.91 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.433 ' O ' HG23 ' A' ' 27' ' ' VAL . 42.8 mmm-85 -66.26 -45.4 80.69 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.564 0.746 . . . . 0.0 111.394 -177.458 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.522 HG21 HD21 ' A' ' 55' ' ' LEU . 75.5 mt -57.07 -45.41 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 123.952 0.782 . . . . 0.0 109.689 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.638 HD21 ' HB3' ' A' ' 63' ' ' LYS . 66.5 mt -65.0 -38.06 89.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.607 0.567 . . . . 0.0 111.169 -179.265 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.42 -44.24 71.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.895 0.747 . . . . 0.0 109.983 -174.838 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 23' ' ' ARG . 98.5 t -58.85 -46.13 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.306 1.043 . . . . 0.0 110.793 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.39 -34.11 77.23 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.328 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -76.56 -45.28 31.22 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.815 0.446 . . . . 0.0 110.714 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -68.53 -42.12 78.91 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.923 0.489 . . . . 0.0 110.628 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.18 -42.06 76.49 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.236 0.96 . . . . 0.0 111.758 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.75 28.06 71.03 Favored Glycine 0 C--N 1.35 1.346 0 O-C-N 123.61 0.568 . . . . 0.0 112.311 -176.03 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.7 p -161.38 154.56 17.8 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.541 1.137 . . . . 0.0 108.693 -172.88 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.457 ' HB3' HG21 ' A' ' 67' ' ' THR . 29.4 Cg_endo -60.86 124.35 14.78 Favored 'Trans proline' 0 C--N 1.374 1.916 0 C-N-CA 122.721 2.281 . . . . 0.0 112.426 178.011 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 72.8 t -105.41 128.06 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.9 mttt -68.29 150.6 48.05 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 41' ' ' VAL . 40.2 tp -56.94 -40.11 75.78 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.44 0.696 . . . . 0.0 110.071 174.434 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.09 -52.83 6.89 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.879 1.272 . . . . 0.0 112.227 167.001 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.457 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 62.4 tt0 -75.39 -25.32 57.53 Favored 'General case' 0 C--O 1.207 -1.167 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.573 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.25 -35.16 80.17 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.73 0.696 . . . . 0.0 110.525 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 37' ' ' LEU . 59.9 t -60.0 -43.03 91.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 C-N-CA 123.499 0.72 . . . . 0.0 110.082 172.399 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -66.82 -57.46 6.99 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.387 1.075 . . . . 0.0 111.017 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -65.37 -53.57 41.5 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.551 1.14 . . . . 0.0 112.415 -174.094 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.2 t -81.36 -12.8 58.89 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 122.732 0.413 . . . . 0.0 110.916 -175.204 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 67.19 13.39 9.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.3 1.44 . . . . 0.0 112.443 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -97.07 153.93 38.34 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 124.275 1.03 . . . . 0.0 111.086 -173.856 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.63 135.82 47.1 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.998 2.465 . . . . 0.0 112.285 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -44.51 -46.09 9.62 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.573 1.149 . . . . 0.0 113.296 174.936 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -60.71 -39.97 90.52 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.208 0.603 . . . . 0.0 112.134 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -66.47 -50.81 62.08 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.294 0.371 . . . . 0.0 110.521 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 36.6 mt -57.38 -57.22 13.6 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 124.168 0.918 . . . . 0.0 110.395 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.408 ' HA ' HD12 ' A' ' 55' ' ' LEU . 27.8 t-20 -51.03 -52.16 45.87 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.24 1.416 . . . . 0.0 112.097 -177.547 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -57.79 -46.53 84.48 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.188 0.595 . . . . 0.0 111.852 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.417 HG21 HD12 ' A' ' 20' ' ' LEU . 90.7 t -63.72 -37.55 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 O-C-N 123.297 0.373 . . . . 0.0 110.141 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.522 HD21 HG21 ' A' ' 24' ' ' ILE . 30.3 mt -58.18 -30.67 66.59 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.488 1.115 . . . . 0.0 113.147 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 56' ' ' TYR . . . . . 0.501 ' HA ' ' HG2' ' A' ' 59' ' ' LYS . 18.7 m-85 -75.84 -25.42 56.23 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-N 119.348 0.976 . . . . 0.0 111.808 176.156 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.468 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.1 tmt_? -70.11 -50.91 36.01 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 171.107 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 85.2 mtp -61.69 -38.82 89.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.783 1.233 . . . . 0.0 112.345 -175.335 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 56' ' ' TYR . 17.5 ptpt -65.56 -37.18 85.96 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 120.785 0.326 . . . . 0.0 111.185 -176.937 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -68.44 -30.67 69.6 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.572 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 11.7 mm-40 -80.82 0.46 34.84 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.269 0.627 . . . . 0.0 111.237 176.113 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 68.23 17.44 9.33 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 125.053 1.341 . . . . 0.0 111.714 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.638 ' HB3' HD21 ' A' ' 25' ' ' LEU . 99.4 mttt -77.66 -37.02 50.78 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.347 0.659 . . . . 0.0 111.702 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.72 146.94 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 CA-C-O 121.719 0.771 . . . . 0.0 111.303 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.7 m -109.29 134.05 52.28 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.968 1.307 . . . . 0.0 109.721 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -96.85 102.37 14.14 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 67' ' ' THR . . . . . 0.457 HG21 ' HB3' ' A' ' 34' ' ' PRO . 9.3 t -92.91 -32.94 14.4 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.257 -171.53 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.772 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.7 m -139.99 158.0 68.2 Favored Pre-proline 0 N--CA 1.478 0.96 0 CA-C-O 117.23 -1.367 . . . . 0.0 108.101 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -25.57 -70.12 0.04 OUTLIER 'Trans proline' 0 C--N 1.393 2.887 1 C-N-CA 125.589 4.193 . . . . 0.0 116.323 -175.025 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.41 17.19 20.37 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.792 0.837 . . . . 0.0 112.275 176.527 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.772 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 42.2 m -109.22 128.98 55.49 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 121.345 0.593 . . . . 0.0 110.439 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.442 ' CE2' HD13 ' A' ' 55' ' ' LEU . 73.9 m95 -112.31 168.19 9.82 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.485 1.114 . . . . 0.0 109.235 -175.242 . . . . . . . . 2 2 . 1 . 012 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 44.6 t -151.36 166.16 31.85 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.673 1.189 . . . . 0.0 108.391 178.134 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 42.6 tp -64.29 133.75 53.34 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 1.223 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 172.435 . . . . . . . . 0 0 . 1 . 013 nuclear build core ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HG3' HG22 ' A' ' 54' ' ' VAL . 44.8 tt0 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 . . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -55.63 -38.16 70.66 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.242 0.339 . . . . 0.0 113.797 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.2 m170 -73.6 -36.56 65.53 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.02 0.528 . . . . 0.0 110.648 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.58 HD11 HD23 ' A' ' 51' ' ' LEU . 2.4 tm? -62.52 -45.39 93.2 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.202 1.001 . . . . 0.0 109.905 177.081 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.34 -44.78 88.89 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.498 1.119 . . . . 0.0 110.444 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 15.9 mm100 -60.02 -39.79 87.08 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 124.059 0.849 . . . . 0.0 111.953 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.417 ' O ' HG23 ' A' ' 27' ' ' VAL . 23.0 tpt180 -68.37 -41.71 80.22 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-O 119.64 -0.219 . . . . 0.0 110.691 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.5 mt -61.51 -47.69 92.22 Favored 'Isoleucine or valine' 0 C--N 1.358 0.956 0 O-C-N 123.316 0.385 . . . . 0.0 110.202 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.498 HD21 ' HB3' ' A' ' 63' ' ' LYS . 95.8 mt -52.69 -44.06 66.01 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.749 0.82 . . . . 0.0 111.923 174.654 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.15 -54.7 25.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.78 0.675 . . . . 0.0 110.768 -177.527 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 23' ' ' ARG . 90.5 t -56.25 -45.86 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.187 0.995 . . . . 0.0 111.434 -177.056 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.604 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.9 mt -64.79 -35.84 82.4 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 123.637 0.586 . . . . 0.0 111.536 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -66.45 -46.18 77.32 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.874 0.469 . . . . 0.0 111.043 176.355 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.53 -40.33 80.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.153 0.581 . . . . 0.0 111.184 -174.229 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.55 87.84 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.006 0.523 . . . . 0.0 110.318 172.318 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.12 37.55 94.13 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.084 -177.587 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.1 t -164.6 152.09 10.21 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.501 0.72 . . . . 0.0 109.682 -167.488 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -50.26 126.53 17.66 Favored 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 123.14 2.56 . . . . 0.0 113.177 168.336 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 69.0 t -118.22 128.87 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.364 1.066 . . . . 0.0 108.31 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 56.4 mtmt -65.11 150.63 47.81 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 123.366 0.416 . . . . 0.0 110.401 176.152 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.444 ' O ' HG23 ' A' ' 41' ' ' VAL . 22.6 tp -61.94 -46.94 87.14 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.648 0.593 . . . . 0.0 110.761 176.46 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.68 -31.54 26.22 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.3 tt0 -80.24 -37.0 33.9 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.668 0.387 . . . . 0.0 110.292 174.436 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.03 -31.85 69.2 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.619 0.767 . . . . 0.0 110.774 178.656 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.49 ' HA ' HD11 ' A' ' 51' ' ' LEU . 25.0 t -54.72 -54.2 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 123.512 0.507 . . . . 0.0 111.493 176.807 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -74.6 -44.66 49.65 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.452 0.47 . . . . 0.0 111.965 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 34.0 mm-40 -59.26 -54.87 41.93 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.3 t -75.21 -16.53 60.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.233 0.613 . . . . 0.0 111.105 -178.711 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 65.21 23.17 12.24 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.2 1.4 . . . . 0.0 112.253 177.795 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.17 151.01 45.3 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.115 0.966 . . . . 0.0 109.831 -178.485 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.62 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 19.9 Cg_endo -59.75 136.59 71.43 Favored 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 122.681 2.254 . . . . 0.0 111.921 174.61 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -47.95 -33.24 7.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.991 1.316 . . . . 0.0 113.285 176.15 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.62 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 14.2 ptp180 -59.78 -46.31 89.57 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.177 0.591 . . . . 0.0 111.037 177.218 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.481 ' HG3' ' HG ' ' A' ' 20' ' ' LEU . 10.3 tp10 -67.09 -49.96 63.22 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.98 0.912 . . . . 0.0 110.521 -178.993 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.58 HD23 HD11 ' A' ' 20' ' ' LEU . 48.2 mt -56.45 -54.07 50.01 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.93 -179.362 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -51.29 -49.51 61.12 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.084 1.353 . . . . 0.0 112.171 -176.745 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.352 0.709 0 O-C-N 123.88 0.738 . . . . 0.0 111.821 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.424 ' O ' ' HG3' ' A' ' 58' ' ' MET . 78.1 t -68.82 -36.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 122.545 0.338 . . . . 0.0 110.785 -176.876 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.4 mt -52.68 -37.88 59.56 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.319 1.048 . . . . 0.0 112.917 173.078 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -70.16 -31.48 68.99 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.642 0.655 . . . . 0.0 111.513 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -64.1 -52.43 59.25 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.424 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 74.9 mtp -62.02 -33.44 74.37 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 124.152 0.981 . . . . 0.0 111.336 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -62.42 -42.31 99.35 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.574 0.749 . . . . 0.0 111.908 175.233 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -69.52 -22.56 63.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.267 0.627 . . . . 0.0 111.273 173.533 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.406 ' HB3' ' HE3' ' A' ' 63' ' ' LYS . 18.6 mm-40 -89.1 -0.28 57.31 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.446 0.698 . . . . 0.0 111.309 173.079 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 65.48 11.17 7.19 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 125.027 1.331 . . . . 0.0 112.43 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.498 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.7 mttt -74.53 -34.82 63.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.869 0.868 . . . . 0.0 111.2 -178.836 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.4 m -128.9 147.07 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.229 0.612 . . . . 0.0 109.637 175.49 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 65' ' ' SER . . . . . 0.631 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 49.0 m -121.0 156.28 32.48 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.962 0.905 . . . . 0.0 109.459 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.7 tp -104.17 103.31 13.07 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.7 t -95.68 -36.4 11.22 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.366 0.666 . . . . 0.0 111.127 -169.143 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.567 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.1 m -139.34 166.8 21.89 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 123.584 0.754 . . . . 0.0 109.469 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -51.06 106.92 0.15 Allowed 'Trans proline' 0 C--N 1.39 2.731 0 C-N-CA 123.177 2.585 . . . . 0.0 113.195 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 66.11 21.31 11.19 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.569 1.148 . . . . 0.0 111.933 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 29.2 m -120.14 122.75 41.71 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 123.937 0.895 . . . . 0.0 108.771 -177.849 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -106.99 169.01 8.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.631 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 24.6 p -150.74 158.49 44.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.604 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 18.7 tp -78.26 105.07 9.25 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.033 0 O-C-N 123.843 0.715 . . . . 0.0 111.327 176.774 . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 . . . . . . . . . 0 0 . 1 . 014 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -69.81 -40.27 75.47 Favored Glycine 0 C--N 1.35 1.33 0 N-CA-C 115.541 0.976 . . . . 0.0 115.541 177.253 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -72.89 -37.95 67.13 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.006 0.908 . . . . 0.0 110.149 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.648 HD11 HD23 ' A' ' 51' ' ' LEU . 3.0 tm? -66.15 -36.43 83.11 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 113.378 -1.737 . . . . 0.0 110.156 174.247 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.421 ' HG3' ' HG2' ' A' ' 58' ' ' MET . 34.6 tt0 -60.64 -46.16 91.35 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.316 1.046 . . . . 0.0 110.32 174.105 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 69.8 mt-30 -65.98 -32.62 74.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.438 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.503 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -66.74 -48.66 68.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.48 0.712 . . . . 0.0 109.353 176.949 . . . . . . . . 3 3 . 1 . 014 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.437 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.2 mt -57.65 -49.17 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 124.275 0.984 . . . . 0.0 109.878 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.509 HD21 ' HB3' ' A' ' 63' ' ' LYS . 78.2 mt -55.8 -40.15 72.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 123.596 0.758 . . . . 0.0 110.832 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -70.87 -41.48 71.31 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 123.865 0.728 . . . . 0.0 110.692 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 23' ' ' ARG . 60.5 t -54.69 -46.34 73.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.298 0.639 . . . . 0.0 110.221 174.692 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 71.2 mt -65.26 -39.76 93.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.253 -178.665 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -69.58 -48.48 60.04 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.279 1.032 . . . . 0.0 112.043 -177.472 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.99 -36.15 81.54 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.616 0.766 . . . . 0.0 110.237 -176.703 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.73 87.51 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.782 171.983 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 24.31 70.34 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.951 -171.272 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -153.35 149.56 21.75 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.413 1.085 . . . . 0.0 109.36 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -55.17 114.66 1.97 Allowed 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.533 2.156 . . . . 0.0 112.277 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.449 HG21 HG12 ' A' ' 27' ' ' VAL . 91.7 t -96.04 131.5 42.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.777 0.831 . . . . 0.0 108.924 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 46.2 mtpt -73.12 151.27 41.66 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.04 0.536 . . . . 0.0 109.943 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.484 ' O ' HG23 ' A' ' 41' ' ' VAL . 36.2 tp -54.09 -44.74 71.47 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.394 1.058 . . . . 0.0 111.199 178.515 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.89 -49.18 11.11 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.043 0.937 . . . . 0.0 112.627 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.43 ' HA ' ' HG2' ' A' ' 42' ' ' LYS . 52.1 tt0 -77.07 -28.18 54.55 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.595 0.358 . . . . 0.0 110.807 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.14 -32.27 73.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.336 0.255 . . . . 0.0 110.358 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.553 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.2 t -59.68 -55.44 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.302 0.641 . . . . 0.0 110.786 175.137 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HG2' ' HA ' ' A' ' 39' ' ' GLN . 20.3 ptmt -69.9 -42.26 73.63 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.601 -174.018 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -72.47 -36.25 68.41 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.8 m -83.75 -17.04 42.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 117.866 0.303 . . . . 0.0 111.443 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 58.94 27.53 16.4 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.533 1.133 . . . . 0.0 111.82 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.68 154.9 54.98 Favored Pre-proline 0 C--O 1.245 0.854 0 C-N-CA 124.283 1.033 . . . . 0.0 109.963 -174.433 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.43 131.13 30.66 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.504 2.136 . . . . 0.0 111.864 177.916 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.544 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.5 ttmt -45.23 -41.05 8.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.486 1.515 . . . . 0.0 113.239 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -53.81 -49.4 68.45 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.816 0.846 . . . . 0.0 111.264 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.97 -44.25 96.56 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 123.467 0.707 . . . . 0.0 110.773 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 20' ' ' LEU . 75.1 mt -54.73 -51.07 66.78 Favored 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.513 1.133 . . . . 0.0 110.671 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.38 -54.73 23.61 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.257 0.973 . . . . 0.0 112.311 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -53.57 -44.89 69.68 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.663 HG12 ' SD ' ' A' ' 58' ' ' MET . 94.8 t -66.37 -51.1 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 122.869 0.467 . . . . 0.0 110.789 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.437 HD13 ' NE1' ' A' ' 72' ' ' TRP . 57.7 mt -48.63 -49.62 36.39 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.509 1.524 . . . . 0.0 114.537 -176.744 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -69.35 -29.43 67.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.451 0.301 . . . . 0.0 111.421 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -67.57 -47.76 68.86 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 174.069 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.663 ' SD ' HG12 ' A' ' 54' ' ' VAL . 73.2 mtp -60.58 -34.06 73.62 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.908 0.883 . . . . 0.0 110.927 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 59' ' ' LYS . . . . . 0.404 ' HB2' ' HZ3' ' A' ' 72' ' ' TRP . 58.2 tttm -64.78 -42.62 94.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.748 0.819 . . . . 0.0 110.82 177.28 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -59.91 -44.05 94.51 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.74 0.816 . . . . 0.0 110.423 172.819 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -78.92 -1.28 34.5 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.469 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt 62.93 15.72 8.58 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 125.343 1.457 . . . . 0.0 112.28 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.509 ' HB3' HD21 ' A' ' 25' ' ' LEU . 92.4 mttt -67.96 -33.24 74.27 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.573 1.149 . . . . 0.0 109.868 173.463 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 28.9 m -129.1 169.43 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.265 0.626 . . . . 0.0 109.451 173.498 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.9 t -134.05 147.32 50.91 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 176.638 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.4 tp -100.54 106.28 17.78 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 35.1 p -93.7 -34.29 13.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.636 0.774 . . . . 0.0 111.772 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.663 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 47.6 t -141.15 154.65 68.07 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -21.68 -67.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.394 2.957 1 C-N-CA 125.594 4.196 . . . . 0.0 116.513 -177.149 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.08 51.69 1.42 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.489 0.661 . . . . 0.0 110.538 173.218 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.663 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 69.3 m -131.87 128.57 38.9 Favored 'General case' 0 C--O 1.243 0.711 0 C-N-CA 123.647 0.779 . . . . 0.0 109.541 172.045 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.437 ' NE1' HD13 ' A' ' 55' ' ' LEU . 75.2 m95 -117.67 142.22 47.49 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.789 0.836 . . . . 0.0 109.701 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 38.7 t -115.87 166.31 12.11 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.585 0.754 . . . . 0.0 109.848 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.83 129.6 40.39 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.708 0.803 . . . . 0.0 109.428 174.861 . . . . . . . . 1 1 . 1 . 014 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.684 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 175.821 . . . . . . . . 0 0 . 1 . 015 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 . . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 22' ' ' GLN . . . -51.51 -38.22 42.44 Favored Glycine 0 C--N 1.346 1.117 0 O-C-N 123.77 0.669 . . . . 0.0 114.442 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -83.39 -32.62 26.07 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.393 0.277 . . . . 0.0 110.817 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' A' ' 51' ' ' LEU . 0.8 OUTLIER -60.35 -53.11 61.54 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.454 1.102 . . . . 0.0 108.937 178.433 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.757 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.6 tt0 -59.48 -47.46 85.41 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.551 176.011 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -60.59 -41.18 94.17 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 123.784 0.678 . . . . 0.0 109.963 -173.463 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.405 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -64.51 -49.62 70.62 Favored 'General case' 0 C--N 1.346 0.426 0 C-N-CA 123.666 0.787 . . . . 0.0 111.968 -178.941 . . . . . . . . 3 3 . 1 . 015 nuclear build core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 76.1 mt -58.62 -49.52 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 124.056 0.848 . . . . 0.0 110.152 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.51 -38.76 91.18 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 123.586 0.754 . . . . 0.0 111.286 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -70.92 -41.41 71.25 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.47 0.481 . . . . 0.0 110.573 -176.693 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 23' ' ' ARG . 86.7 t -63.31 -37.52 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.105 0.562 . . . . 0.0 110.338 176.68 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.511 HD22 ' HA ' ' A' ' 73' ' ' CYS . 89.5 mt -71.09 -28.94 64.7 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.767 0.427 . . . . 0.0 111.123 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 99.0 m -73.6 -49.58 25.49 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.048 0.939 . . . . 0.0 111.632 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -66.85 -32.08 73.11 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.158 0.583 . . . . 0.0 110.572 -176.2 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.32 -47.73 80.98 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.918 169.971 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.66 27.29 69.61 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.975 0.797 . . . . 0.0 111.332 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.4 t -160.5 151.13 15.29 Favored Pre-proline 0 C--O 1.245 0.86 0 C-N-CA 124.478 1.111 . . . . 0.0 109.238 -166.155 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -56.52 123.83 14.78 Favored 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 122.738 2.292 . . . . 0.0 112.209 172.575 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 88.0 t -113.62 137.21 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.475 1.11 . . . . 0.0 108.61 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 95.1 mttt -75.1 148.56 39.62 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 123.221 0.608 . . . . 0.0 109.456 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.505 ' O ' HG23 ' A' ' 41' ' ' VAL . 45.6 tp -54.01 -43.09 69.77 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 124.544 1.152 . . . . 0.0 111.013 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -43.2 -51.06 6.25 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.502 1.121 . . . . 0.0 113.184 170.57 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -74.42 -30.91 62.11 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.931 0.493 . . . . 0.0 110.84 -179.092 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 37' ' ' LEU . 97.0 mt -61.83 -33.6 74.44 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.897 0.479 . . . . 0.0 110.192 175.895 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 37' ' ' LEU . 60.9 t -59.38 -55.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.609 0.764 . . . . 0.0 111.738 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -68.67 -41.98 78.52 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 123.853 0.721 . . . . 0.0 111.003 -174.007 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -67.81 -48.17 67.03 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.208 0.603 . . . . 0.0 112.03 -178.098 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 63.6 m -77.83 -13.67 59.81 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.004 0.521 . . . . 0.0 111.325 -177.421 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 57.69 40.57 26.39 Favored 'General case' 0 C--N 1.364 1.203 0 C-N-CA 124.253 1.021 . . . . 0.0 110.407 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.486 ' HB3' HD21 ' A' ' 51' ' ' LEU . . . -138.6 154.29 73.14 Favored Pre-proline 0 CA--C 1.553 1.075 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.599 -172.509 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -60.61 129.06 27.88 Favored 'Trans proline' 0 C--N 1.381 2.269 0 C-N-CA 123.198 2.598 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -41.0 -48.82 3.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.178 1.391 . . . . 0.0 114.08 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 82.1 mtm180 -59.24 -45.45 91.13 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 123.87 0.731 . . . . 0.0 111.061 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.06 -46.28 81.83 Favored 'General case' 0 C--O 1.241 0.622 0 O-C-N 123.957 0.786 . . . . 0.0 109.661 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.576 ' HA ' HD11 ' A' ' 20' ' ' LEU . 81.3 mt -56.1 -49.86 72.66 Favored 'General case' 0 C--N 1.356 0.874 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.927 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.403 ' HA ' HD12 ' A' ' 55' ' ' LEU . 16.2 t30 -63.15 -43.4 98.42 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.385 1.053 . . . . 0.0 112.698 -173.997 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 78.8 mm-40 -60.97 -45.39 94.97 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 120.573 0.225 . . . . 0.0 111.058 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.5 t -66.17 -38.33 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.341 0.656 . . . . 0.0 110.705 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 52' ' ' ASN . 14.7 mt -53.1 -39.64 63.54 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.684 1.193 . . . . 0.0 112.767 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -68.03 -35.31 78.06 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 118.417 0.553 . . . . 0.0 112.033 179.129 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.492 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 66.1 ttp85 -68.01 -50.34 56.07 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.757 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 69.6 mtm -62.27 -28.39 69.68 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.989 0.806 . . . . 0.0 111.678 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -71.84 -38.91 70.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -63.44 -39.91 95.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.304 0.642 . . . . 0.0 110.414 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.33 -2.54 45.8 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.759 0.824 . . . . 0.0 111.436 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.1 mt 68.59 10.33 7.82 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.155 1.382 . . . . 0.0 112.529 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 64.5 mttm -64.66 -32.02 73.5 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.875 0.87 . . . . 0.0 110.416 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 18.5 m -130.62 165.37 31.1 Favored 'Isoleucine or valine' 0 C--O 1.245 0.834 0 C-N-CA 124.106 0.962 . . . . 0.0 109.115 172.678 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 t -143.44 145.13 32.36 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.5 tp -95.7 103.88 15.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.151 0.58 . . . . 0.0 109.546 -172.741 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 33.5 p -84.16 -45.62 12.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.572 0.749 . . . . 0.0 112.082 -174.205 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.477 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 17.8 m -132.29 169.43 13.91 Favored Pre-proline 0 N--CA 1.479 0.999 0 CA-C-O 117.44 -1.267 . . . . 0.0 107.587 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 2.3 Cg_exo -29.09 -78.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 124.689 3.593 . . . . 0.0 115.266 178.529 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -100.18 19.52 16.31 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 118.89 0.768 . . . . 0.0 112.026 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 20.6 m -107.97 125.85 52.01 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.134 0.492 . . . . 0.0 109.859 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.16 168.35 10.19 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.511 ' HA ' HD22 ' A' ' 28' ' ' LEU . 35.4 t -149.06 164.41 34.72 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.885 . . . . . . . . 2 2 . 1 . 015 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.1 tp -65.98 143.82 57.14 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.529 0.518 . . . . 0.0 109.724 175.898 . . . . . . . . 1 1 . 1 . 015 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 0.993 0 O-C-N 123.649 0.593 . . . . 0.0 113.249 178.691 . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 N--CA 1.489 1.486 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 . . . . . . . . . 0 0 . 1 . 016 nuclear build core ' A' A ' 18' ' ' GLY . . . . . 0.439 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -66.3 -27.59 73.13 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-O 120.145 -0.253 . . . . 0.0 113.315 177.127 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -73.76 -35.15 64.97 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.637 0.775 . . . . 0.0 109.163 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.5 HD12 HG21 ' A' ' 54' ' ' VAL . 2.8 tm? -66.88 -39.36 87.46 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.784 1.634 . . . . 0.0 108.978 176.335 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -66.71 -38.44 86.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.965 0.906 . . . . 0.0 110.202 177.199 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 22' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 56.0 mt-30 -62.69 -40.19 96.33 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.879 0.872 . . . . 0.0 110.455 174.228 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -68.52 -42.87 77.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 123.614 0.766 . . . . 0.0 111.599 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.1 mt -58.89 -52.3 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 123.827 0.705 . . . . 0.0 109.361 177.926 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.643 HD21 ' HB3' ' A' ' 63' ' ' LYS . 91.5 mt -58.27 -40.47 81.95 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.493 0.717 . . . . 0.0 111.367 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -67.48 -49.07 65.18 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.468 0.707 . . . . 0.0 111.092 -177.294 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.44 -39.49 79.29 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.534 1.134 . . . . 0.0 111.349 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 73' ' ' CYS . 85.7 mt -67.89 -40.02 83.58 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.875 0.87 . . . . 0.0 110.915 176.619 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -68.48 -48.83 63.46 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.999 0.919 . . . . 0.0 111.426 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -71.42 -39.51 71.03 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 123.182 0.593 . . . . 0.0 110.95 -173.469 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.6 -33.63 75.38 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.505 0.503 . . . . 0.0 111.059 173.585 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.36 32.52 84.47 Favored Glycine 0 C--N 1.354 1.542 0 O-C-N 123.959 0.787 . . . . 0.0 112.771 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 p -170.31 155.86 5.31 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 124.192 0.997 . . . . 0.0 109.141 -171.348 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.561 ' HB3' ' HB2' ' A' ' 73' ' ' CYS . 20.2 Cg_endo -60.92 118.26 5.11 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.728 2.285 . . . . 0.0 112.998 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.79 135.66 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -66.11 143.75 57.12 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.511 0.724 . . . . 0.0 109.986 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.51 HD13 HD11 ' A' ' 55' ' ' LEU . 13.1 tp -61.26 -41.77 97.49 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.912 0.885 . . . . 0.0 110.67 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.5 -41.91 10.13 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.094 0.957 . . . . 0.0 113.42 167.736 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.544 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 34.6 tt0 -82.89 -29.45 29.27 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.1 mt -60.05 -34.63 73.67 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.683 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.423 ' HA ' HD11 ' A' ' 51' ' ' LEU . 91.5 t -51.8 -56.32 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 124.708 1.203 . . . . 0.0 111.701 175.206 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -71.53 -37.51 71.17 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.181 -173.727 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 9.1 mm-40 -61.38 -53.11 60.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.03 0.532 . . . . 0.0 111.704 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 46' ' ' ALA . 30.4 p -83.93 -10.32 58.05 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.113 0.565 . . . . 0.0 111.127 -176.33 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 63.67 17.59 10.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.623 1.169 . . . . 0.0 111.797 -178.87 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.528 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -107.98 151.84 41.45 Favored Pre-proline 0 N--CA 1.476 0.828 0 C-N-CA 124.134 0.974 . . . . 0.0 110.867 -175.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.3 140.24 81.82 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.548 2.165 . . . . 0.0 111.575 175.383 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -47.1 -34.32 5.88 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 124.19 0.996 . . . . 0.0 112.553 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 49' ' ' ARG . . . . . 0.44 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 20.4 tpp180 -61.82 -47.38 85.33 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.241 0.616 . . . . 0.0 111.779 177.303 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -62.66 -47.31 84.26 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 123.326 0.65 . . . . 0.0 110.249 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.492 ' HA ' HD11 ' A' ' 20' ' ' LEU . 17.3 mt -53.34 -56.46 16.53 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 124.62 1.168 . . . . 0.0 110.893 176.151 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -49.21 -52.53 26.31 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 126.091 1.757 . . . . 0.0 111.868 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 53' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 14.3 mm100 -53.42 -47.99 69.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.945 0.898 . . . . 0.0 111.667 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.5 HG21 HD12 ' A' ' 20' ' ' LEU . 85.1 t -68.32 -44.89 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.25 -179.07 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.51 HD11 HD13 ' A' ' 37' ' ' LEU . 54.6 mt -52.32 -44.51 65.14 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.496 1.518 . . . . 0.0 114.306 -177.211 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -62.89 -32.45 73.71 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.202 0.456 . . . . 0.0 111.071 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.46 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.5 mmm-85 -70.68 -49.17 50.09 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 123.03 0.532 . . . . 0.0 109.768 177.352 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 70.7 mtp -57.77 -36.12 71.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.114 0.966 . . . . 0.0 111.618 -177.159 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -59.4 -44.04 92.87 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.427 0.691 . . . . 0.0 110.246 176.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -75.29 -25.33 57.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.502 1.121 . . . . 0.0 111.81 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 7.0 mm-40 -77.83 -4.65 47.63 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.041 0.536 . . . . 0.0 110.001 170.935 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 83.1 mt 68.32 19.19 9.04 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 125.541 1.536 . . . . 0.0 111.438 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.643 ' HB3' HD21 ' A' ' 25' ' ' LEU . 98.8 mttt -80.72 -33.42 35.26 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.782 1.233 . . . . 0.0 111.711 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.9 m -132.74 161.75 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-O 121.267 0.556 . . . . 0.0 111.189 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.6 t -132.31 145.34 51.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.904 1.281 . . . . 0.0 108.61 174.1 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 47.0 tp -95.67 109.01 21.35 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 37.3 p -84.78 -44.57 13.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.161 0.584 . . . . 0.0 111.168 -175.46 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.644 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 13.1 m -134.72 159.5 71.93 Favored Pre-proline 0 CA--C 1.555 1.141 0 CA-C-O 117.212 -1.375 . . . . 0.0 107.64 -175.852 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -29.68 -66.02 0.07 OUTLIER 'Trans proline' 0 C--N 1.396 3.059 0 C-N-CA 125.017 3.811 . . . . 0.0 116.243 -174.547 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.65 40.07 3.02 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.924 0.889 . . . . 0.0 111.084 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.644 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 91.1 m -131.2 122.82 27.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.606 0.762 . . . . 0.0 109.869 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.5 m95 -114.25 151.47 32.79 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.119 0.968 . . . . 0.0 108.698 -172.829 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.561 ' HB2' ' HB3' ' A' ' 34' ' ' PRO . 42.7 t -132.54 170.26 15.41 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.053 0.941 . . . . 0.0 109.209 177.904 . . . . . . . . 2 2 . 1 . 016 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.0 tp -68.49 160.31 30.06 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.313 0 C-N-CA 122.74 0.209 . . . . 0.0 112.722 179.512 . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 121.065 0.46 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 017 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.72 -30.27 72.74 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.643 -1.162 . . . . 0.0 113.458 179.279 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -74.68 -39.1 62.2 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.475 HD12 HG21 ' A' ' 54' ' ' VAL . 2.4 tm? -65.11 -40.87 95.15 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.444 1.098 . . . . 0.0 110.403 173.332 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.739 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 19.5 tt0 -58.28 -49.97 75.26 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.313 1.445 . . . . 0.0 110.974 175.81 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -66.32 -31.6 72.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.916 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.422 ' O ' HG23 ' A' ' 27' ' ' VAL . 20.6 tpp180 -62.74 -47.15 84.82 Favored 'General case' 0 C--N 1.351 0.637 0 C-N-CA 122.944 0.498 . . . . 0.0 110.553 174.221 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 20' ' ' LEU . 68.6 mt -60.09 -46.94 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.859 0.725 . . . . 0.0 109.9 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.487 HD11 ' HD3' ' A' ' 63' ' ' LYS . 93.2 mt -62.16 -35.89 80.17 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.547 0.739 . . . . 0.0 110.97 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 26' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 29.8 tt0 -70.28 -44.66 67.94 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.885 0.741 . . . . 0.0 110.567 178.734 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 23' ' ' ARG . 55.8 t -54.23 -44.59 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.979 0.912 . . . . 0.0 110.938 174.834 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.9 mt -66.26 -37.45 85.51 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -64.22 -51.16 65.01 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.167 0.987 . . . . 0.0 111.605 177.786 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 30' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 15.7 mm-40 -63.29 -46.6 86.0 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.223 0.609 . . . . 0.0 111.444 -173.523 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.95 -38.29 90.46 Favored 'General case' 0 C--O 1.24 0.578 0 O-C-N 124.177 0.923 . . . . 0.0 110.573 178.257 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.57 -56.8 4.91 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.142 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.1 p -72.58 161.92 76.72 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 124.12 0.968 . . . . 0.0 110.835 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -50.41 142.59 29.5 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.982 2.455 . . . . 0.0 113.368 172.442 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 39.6 t -121.79 132.1 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.731 0.812 . . . . 0.0 109.426 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -69.96 148.42 48.94 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.04 0.536 . . . . 0.0 109.806 176.506 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HG ' ' HG3' ' A' ' 48' ' ' LYS . 38.7 tp -60.78 -45.26 95.05 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.679 1.192 . . . . 0.0 110.494 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.63 -37.66 18.82 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.334 1.054 . . . . 0.0 113.509 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -82.48 -28.84 30.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.64 0.376 . . . . 0.0 110.908 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 37' ' ' LEU . 94.3 mt -60.55 -32.36 71.43 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 122.458 0.303 . . . . 0.0 110.219 174.314 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 37' ' ' LEU . 27.8 t -56.59 -56.21 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 123.945 0.898 . . . . 0.0 111.789 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -64.22 -47.08 81.08 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.591 0.557 . . . . 0.0 110.961 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.74 -48.11 82.17 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.453 0.701 . . . . 0.0 112.788 -178.243 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 64.4 m -82.67 -12.29 57.73 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.663 0.385 . . . . 0.0 111.971 -176.885 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 57.23 31.4 20.0 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.779 0.832 . . . . 0.0 111.866 -179.251 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 46' ' ' ALA . . . . . 0.424 ' HB3' HD21 ' A' ' 51' ' ' LEU . . . -125.14 154.61 71.68 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.727 -174.974 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 47' ' ' PRO . . . . . 0.462 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 31.1 Cg_endo -62.22 132.31 38.28 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 121.851 1.701 . . . . 0.0 110.961 175.977 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG3' ' HG ' ' A' ' 37' ' ' LEU . 40.5 ttmt -40.01 -43.99 1.66 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.976 1.31 . . . . 0.0 113.42 174.722 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -58.48 -42.3 87.2 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.182 0.993 . . . . 0.0 112.125 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 50' ' ' GLU . . . . . 0.462 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 10.0 tp10 -64.64 -50.18 68.12 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.698 0.799 . . . . 0.0 109.831 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.424 HD21 ' HB3' ' A' ' 46' ' ' ALA . 51.8 mt -59.42 -54.62 44.59 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.211 1.005 . . . . 0.0 111.503 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 52' ' ' ASN . . . . . 0.51 ' HA ' HD12 ' A' ' 55' ' ' LEU . 58.2 t30 -50.87 -51.2 53.91 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.282 1.833 . . . . 0.0 112.072 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.6 -43.55 98.52 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 123.729 0.643 . . . . 0.0 111.332 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.475 HG21 HD12 ' A' ' 20' ' ' LEU . 83.1 t -65.54 -35.61 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 52' ' ' ASN . 30.9 mt -56.94 -37.54 71.66 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.105 0.962 . . . . 0.0 112.82 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -70.03 -33.43 71.97 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.766 0.712 . . . . 0.0 111.085 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -70.72 -48.25 55.57 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.916 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.739 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 74.9 mtm -64.4 -29.11 70.18 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.857 0.863 . . . . 0.0 111.679 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -63.45 -40.98 98.6 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.053 0.541 . . . . 0.0 110.562 175.333 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -71.46 -25.3 62.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.283 0.633 . . . . 0.0 111.135 176.165 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -85.0 -2.53 58.07 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.283 0.633 . . . . 0.0 111.647 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 66.58 17.1 10.57 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.922 1.289 . . . . 0.0 112.469 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.552 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 96.6 mttt -73.2 -38.61 66.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.043 0.937 . . . . 0.0 110.99 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.438 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 18.6 m -127.1 164.41 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.451 0.7 . . . . 0.0 110.14 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.5 m -144.91 151.66 39.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.0 tp -96.03 101.61 13.29 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.6 p -84.69 -41.78 15.93 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.544 0.738 . . . . 0.0 111.557 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.435 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 49.1 m -134.93 167.77 21.12 Favored Pre-proline 0 N--CA 1.481 1.124 0 C-N-CA 123.751 0.82 . . . . 0.0 109.64 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.98 110.78 0.41 Allowed 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 122.976 2.451 . . . . 0.0 112.867 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.8 33.73 17.6 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.982 1.313 . . . . 0.0 111.56 -178.082 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.435 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 51.0 m -129.67 121.76 27.62 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -118.45 142.47 47.53 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.275 1.03 . . . . 0.0 108.315 -174.12 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 33.7 t -130.4 165.74 21.94 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 30.2 tp -74.61 102.53 4.6 Favored 'General case' 0 C--O 1.24 0.584 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.438 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . . . . . . 0 C--N 1.34 0.794 0 O-C-N 123.896 0.748 . . . . 0.0 111.524 -178.313 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.429 0.156 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 018 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.9 -44.2 89.55 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 124.045 0.841 . . . . 0.0 114.762 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -70.67 -39.6 73.48 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.929 0.864 . . . . 0.0 110.972 -175.373 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.445 ' O ' HG13 ' A' ' 24' ' ' ILE . 2.4 tm? -64.98 -40.29 94.75 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.348 0.659 . . . . 0.0 110.1 174.788 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -58.66 -47.76 83.37 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.295 1.038 . . . . 0.0 111.395 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -36.88 82.8 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.039 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.427 ' O ' HG23 ' A' ' 27' ' ' VAL . 16.4 tpt180 -67.41 -41.63 84.56 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.083 0.553 . . . . 0.0 111.011 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.474 HG21 HD21 ' A' ' 55' ' ' LEU . 79.4 mt -60.28 -52.93 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 122.836 0.454 . . . . 0.0 110.432 176.369 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.18 -32.68 72.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.503 0.721 . . . . 0.0 111.09 -178.458 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -63.55 -52.13 62.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.354 1.061 . . . . 0.0 109.926 176.993 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 23' ' ' ARG . 76.1 t -58.2 -41.86 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.966 0.906 . . . . 0.0 110.591 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.479 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 97.5 mt -69.88 -36.0 75.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.302 0.641 . . . . 0.0 111.695 -177.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -70.44 -45.04 66.61 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.359 0.663 . . . . 0.0 111.861 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -71.81 -33.42 68.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.948 0.499 . . . . 0.0 111.326 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.79 68.98 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 168.822 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.84 26.53 67.2 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.643 -175.689 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.1 t -152.53 150.6 25.3 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.262 1.025 . . . . 0.0 109.028 -171.307 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.19 125.11 15.49 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.675 2.25 . . . . 0.0 113.32 173.185 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.94 132.8 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.143 0.977 . . . . 0.0 108.521 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 54.7 mtpt -64.35 151.7 43.24 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.492 0.717 . . . . 0.0 111.19 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.416 ' O ' HG23 ' A' ' 41' ' ' VAL . 51.9 tp -62.4 -50.51 71.26 Favored 'General case' 0 C--N 1.356 0.855 0 O-C-N 123.424 0.452 . . . . 0.0 109.852 176.382 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.03 -37.95 10.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.99 0.916 . . . . 0.0 112.848 170.919 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 39' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 61.6 tt0 -78.31 -34.66 48.57 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.253 0.621 . . . . 0.0 110.619 -179.475 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 66.9 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.601 0.761 . . . . 0.0 110.815 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 37' ' ' LEU . 35.8 t -55.49 -50.88 63.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.37 0.668 . . . . 0.0 111.706 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -76.26 -43.62 41.05 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.986 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 43' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -59.59 -56.51 20.96 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.274 0.488 . . . . 0.0 112.039 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 62.7 m -72.74 -8.39 55.16 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.827 0.451 . . . . 0.0 111.632 -177.807 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 61.9 22.87 13.37 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.017 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.84 149.01 58.35 Favored Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.92 -164.417 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.47 133.14 29.2 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.508 2.139 . . . . 0.0 111.761 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -42.15 -36.14 1.11 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.734 1.613 . . . . 0.0 112.934 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.9 ttm105 -54.6 -56.62 17.09 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.355 1.062 . . . . 0.0 112.21 176.222 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -44.75 79.53 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.873 -176.787 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.7 mt -55.37 -59.71 4.43 Favored 'General case' 0 C--O 1.212 -0.881 0 O-C-N 124.082 0.864 . . . . 0.0 111.093 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -48.4 -56.12 9.01 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.278 1.431 . . . . 0.0 112.089 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.33 -52.61 64.63 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.779 0.832 . . . . 0.0 112.101 -177.441 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.544 HG12 ' SD ' ' A' ' 58' ' ' MET . 97.4 t -67.05 -38.0 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 122.821 0.448 . . . . 0.0 110.204 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.474 HD21 HG21 ' A' ' 24' ' ' ILE . 17.4 mt -54.06 -40.38 67.1 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.685 1.194 . . . . 0.0 114.137 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -71.76 -24.32 61.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 119.436 1.016 . . . . 0.0 111.365 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -73.61 -48.82 29.76 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.544 ' SD ' HG12 ' A' ' 54' ' ' VAL . 66.0 mtp -60.68 -37.74 82.64 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.603 1.161 . . . . 0.0 111.476 179.3 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -58.51 -45.97 87.69 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.424 1.09 . . . . 0.0 110.599 175.397 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 60' ' ' LYS . . . . . 0.43 ' NZ ' ' HB2' ' A' ' 60' ' ' LYS . 4.3 ttmp? -72.77 -26.45 61.54 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.096 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -85.52 -2.17 57.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.831 0.852 . . . . 0.0 111.265 174.551 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 69.95 12.17 7.81 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.978 1.311 . . . . 0.0 112.306 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 94.4 mttt -70.03 -37.13 75.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.726 0.81 . . . . 0.0 110.792 175.272 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 22.2 m -131.25 175.77 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.734 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.3 t -144.13 158.13 43.9 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 30.5 tp -109.56 113.16 25.72 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 175.764 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.6 p -100.47 -31.95 11.04 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.572 0.749 . . . . 0.0 111.283 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.684 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 39.2 t -139.23 148.37 56.82 Favored Pre-proline 0 CA--C 1.552 1.035 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -26.0 -72.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.39 2.739 1 C-N-CA 125.407 4.071 . . . . 0.0 116.721 -172.39 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.84 39.34 2.4 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.345 0.658 . . . . 0.0 111.008 177.013 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.684 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 86.2 m -131.27 123.02 27.48 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.801 0.84 . . . . 0.0 109.239 176.535 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -104.51 160.34 15.01 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.622 -173.133 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 51.8 t -138.63 156.17 47.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build core ' A' A ' 74' ' ' LEU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 35.7 tp -76.21 131.03 39.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.393 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear build core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.924 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 178.377 . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 110.517 -0.179 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 019 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.05 -32.06 81.31 Favored Glycine 0 C--N 1.342 0.865 0 O-C-N 123.5 0.5 . . . . 0.0 113.369 174.891 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -65.58 -45.28 83.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.439 0.638 . . . . 0.0 109.403 176.099 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.599 HD12 HG21 ' A' ' 54' ' ' VAL . 2.3 tm? -67.4 -37.63 83.4 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 113.943 -1.481 . . . . 0.0 111.404 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -65.18 -43.19 92.48 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.015 0.926 . . . . 0.0 110.709 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -66.9 -34.42 77.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.753 175.458 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.524 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -59.48 -52.7 64.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.234 0.614 . . . . 0.0 110.791 174.185 . . . . . . . . 3 3 . 1 . 019 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.475 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.3 mt -55.57 -48.81 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 O-C-N 124.251 0.969 . . . . 0.0 110.449 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.571 HD21 ' HB3' ' A' ' 63' ' ' LYS . 89.0 mt -62.56 -37.14 84.99 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.217 0.607 . . . . 0.0 111.568 -178.838 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -66.74 -47.92 70.77 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.743 0.652 . . . . 0.0 110.465 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 23' ' ' ARG . 85.2 t -56.79 -40.49 71.1 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.153 0.981 . . . . 0.0 110.885 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 93.4 mt -69.47 -38.82 77.88 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.069 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.2 m -69.37 -45.97 68.07 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.546 0.738 . . . . 0.0 111.677 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -68.88 -34.83 76.08 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.437 0.695 . . . . 0.0 110.613 -176.796 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.76 83.23 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.7 171.161 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.7 28.89 68.76 Favored Glycine 0 C--N 1.352 1.429 0 O-C-N 123.946 0.779 . . . . 0.0 111.853 -171.024 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.5 t -162.19 147.51 10.13 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.41 1.084 . . . . 0.0 109.057 -165.754 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 34' ' ' PRO . . . . . 0.401 ' HG3' ' HB2' ' A' ' 73' ' ' CYS . 74.3 Cg_exo -51.86 114.77 1.75 Allowed 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 123.163 2.575 . . . . 0.0 113.757 174.79 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 35' ' ' VAL . . . . . 0.403 HG21 HG12 ' A' ' 27' ' ' VAL . 90.1 t -96.37 146.75 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.056 0.942 . . . . 0.0 109.691 179.214 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -82.01 152.56 26.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.505 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.45 ' HA ' HD12 ' A' ' 40' ' ' LEU . 39.1 tp -57.61 -49.46 76.35 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.517 1.127 . . . . 0.0 111.053 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.66 -32.58 42.9 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -83.88 -27.48 28.62 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.959 0.409 . . . . 0.0 110.199 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 40' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 37' ' ' LEU . 91.6 mt -65.64 -28.65 69.26 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.581 0.753 . . . . 0.0 110.504 174.061 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.582 ' HA ' HD11 ' A' ' 51' ' ' LEU . 91.8 t -56.21 -52.3 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.004 0.522 . . . . 0.0 111.926 -178.565 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -71.5 -50.73 28.65 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 123.561 0.538 . . . . 0.0 111.166 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.9 -49.38 46.44 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 123.492 0.717 . . . . 0.0 111.391 -172.777 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 44' ' ' CYS . . . . . 0.489 ' HA ' ' HB3' ' A' ' 23' ' ' ARG . 54.6 m -76.46 -11.7 59.92 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.511 0.324 . . . . 0.0 111.276 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 62.85 51.3 3.01 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.266 1.026 . . . . 0.0 111.644 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -149.74 152.06 33.97 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 123.007 0.523 . . . . 0.0 110.652 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.83 145.92 94.85 Favored 'Trans proline' 0 C--N 1.366 1.5 0 C-N-CA 122.496 2.131 . . . . 0.0 111.727 173.127 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -39.44 -56.58 1.58 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.87 1.268 . . . . 0.0 113.735 177.6 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -58.11 -36.37 72.8 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.611 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.94 -48.3 74.57 Favored 'General case' 0 C--O 1.245 0.853 0 O-C-N 123.54 0.525 . . . . 0.0 109.978 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.582 HD11 ' HA ' ' A' ' 41' ' ' VAL . 57.3 mt -55.35 -53.25 58.49 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 124.521 1.138 . . . . 0.0 111.52 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -49.76 -50.1 45.82 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 124.383 1.052 . . . . 0.0 112.285 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -56.79 -46.52 81.5 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 124.313 1.008 . . . . 0.0 111.067 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.599 HG21 HD12 ' A' ' 20' ' ' LEU . 54.0 t -70.32 -43.16 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.877 0.471 . . . . 0.0 110.835 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 55' ' ' LEU . . . . . 0.407 HD13 ' NE1' ' A' ' 72' ' ' TRP . 60.8 mt -51.9 -49.67 62.57 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.03 1.332 . . . . 0.0 114.078 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -71.69 -26.31 62.46 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 118.08 0.4 . . . . 0.0 110.927 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 57' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.8 tmt_? -68.43 -52.28 34.52 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.479 0.711 . . . . 0.0 109.431 174.462 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.504 ' SD ' HG12 ' A' ' 54' ' ' VAL . 83.3 mtp -61.11 -29.25 69.65 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.695 1.198 . . . . 0.0 111.498 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -63.78 -41.96 97.86 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.944 0.497 . . . . 0.0 110.575 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -71.49 -28.55 64.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 123.83 0.706 . . . . 0.0 110.758 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 61' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.01 -2.65 45.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.125 0.57 . . . . 0.0 110.921 173.201 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 74.4 mt 63.88 16.11 9.6 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.036 1.334 . . . . 0.0 112.115 178.62 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.571 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.9 mttt -77.06 -32.46 56.85 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.257 1.023 . . . . 0.0 110.637 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.405 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 22.0 m -129.51 164.18 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 26.7 t -137.11 148.25 46.56 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.53 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.0 tp -100.57 106.58 18.1 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 11.6 p -88.18 -43.97 11.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.902 0.881 . . . . 0.0 111.063 -176.869 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 34.3 t -140.73 153.71 68.14 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -177.135 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.02 112.75 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.528 0 C-N-CA 123.235 2.623 . . . . 0.0 114.608 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 68.73 20.41 8.17 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.856 1.262 . . . . 0.0 112.075 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 6.2 m -126.04 115.48 19.93 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.713 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 72' ' ' TRP . . . . . 0.407 ' NE1' HD13 ' A' ' 55' ' ' LEU . 82.5 m95 -115.99 142.98 46.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.712 0.805 . . . . 0.0 109.797 -167.704 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 73' ' ' CYS . . . . . 0.401 ' HB2' ' HG3' ' A' ' 34' ' ' PRO . 53.4 t -113.94 161.47 17.6 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 123.223 0.609 . . . . 0.0 110.213 177.712 . . . . . . . . 2 2 . 1 . 019 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.58 102.38 0.9 Allowed 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.511 . . . . . . . . 1 1 . 1 . 019 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.405 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . . . . . . 0 C--N 1.343 0.924 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.647 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 . . . . . 0 N--CA 1.483 1.18 0 CA-C-O 119.477 -0.297 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 020 nuclear build core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.62 -32.82 61.29 Favored Glycine 0 C--N 1.347 1.174 0 O-C-N 124.262 0.976 . . . . 0.0 114.275 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -67.47 -51.97 44.91 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.818 0.447 . . . . 0.0 110.555 176.155 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 20' ' ' LEU . . . . . 0.575 HD11 HD23 ' A' ' 51' ' ' LEU . 2.7 tm? -63.44 -37.18 86.29 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.996 1.319 . . . . 0.0 110.652 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 21' ' ' GLU . . . . . 0.749 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 29.3 tt0 -56.56 -48.72 76.73 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.537 1.135 . . . . 0.0 110.305 171.235 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -62.84 -38.88 92.54 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.152 -177.338 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 23' ' ' ARG . . . . . 0.504 ' O ' HG23 ' A' ' 27' ' ' VAL . 26.8 mmt180 -64.96 -51.91 59.18 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 122.764 0.425 . . . . 0.0 111.477 178.661 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 24' ' ' ILE . . . . . 0.47 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 61.6 mt -57.35 -47.85 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 O-C-N 123.865 0.728 . . . . 0.0 110.514 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 25' ' ' LEU . . . . . 0.458 HD21 ' HB3' ' A' ' 63' ' ' LYS . 94.3 mt -65.55 -32.95 74.81 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.189 0.596 . . . . 0.0 111.422 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -69.94 -43.02 72.44 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.497 0.498 . . . . 0.0 110.102 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 27' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 23' ' ' ARG . 87.8 t -56.57 -43.5 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.684 0.794 . . . . 0.0 110.748 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 28' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 79.9 mt -66.56 -42.82 86.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.293 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.5 m -72.85 -38.17 67.17 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.187 0.995 . . . . 0.0 111.91 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.51 -42.65 74.43 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.751 0.42 . . . . 0.0 110.644 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.99 -36.94 83.28 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.722 0.639 . . . . 0.0 110.862 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 59.11 34.12 77.93 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 124.155 0.909 . . . . 0.0 112.508 -174.81 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.9 t -164.29 151.56 10.25 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.459 1.104 . . . . 0.0 108.615 -166.949 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.59 118.87 5.56 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.366 2.711 . . . . 0.0 112.607 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 46.6 t -102.96 127.58 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -68.95 150.49 47.66 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.421 0.689 . . . . 0.0 110.709 -178.253 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 37' ' ' LEU . . . . . 0.531 HD21 ' HG3' ' A' ' 48' ' ' LYS . 57.6 tp -58.58 -46.78 86.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.076 0.95 . . . . 0.0 111.373 -179.431 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.86 -35.93 46.67 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.937 0.895 . . . . 0.0 113.269 171.328 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.33 -34.13 48.78 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.9 mt -64.18 -33.42 75.74 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.954 0.902 . . . . 0.0 110.728 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 41' ' ' VAL . . . . . 0.582 ' HA ' HD11 ' A' ' 51' ' ' LEU . 83.4 t -58.91 -47.74 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 123.318 0.647 . . . . 0.0 110.259 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -67.4 -54.04 23.94 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.28 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -70.29 -48.95 54.36 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.803 0.841 . . . . 0.0 112.867 -171.703 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 44.3 m -77.31 -16.06 59.12 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 62.74 56.28 1.96 Allowed 'General case' 0 C--N 1.364 1.215 0 C-N-CA 124.295 1.038 . . . . 0.0 110.574 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.43 151.32 36.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.105 -173.626 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -59.54 137.61 78.74 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.834 2.356 . . . . 0.0 111.969 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HG3' HD21 ' A' ' 37' ' ' LEU . 22.7 ttmm -35.1 -48.35 0.42 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.595 1.558 . . . . 0.0 112.945 169.741 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -61.33 -48.34 81.8 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 111.82 -178.912 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.9 -46.72 86.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.287 0.635 . . . . 0.0 110.164 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 51' ' ' LEU . . . . . 0.582 HD11 ' HA ' ' A' ' 41' ' ' VAL . 83.6 mt -52.79 -53.71 44.43 Favored 'General case' 0 C--O 1.206 -1.204 0 O-C-N 124.353 1.033 . . . . 0.0 110.735 174.434 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -59.21 -46.37 88.64 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.582 1.177 . . . . 0.0 112.766 -175.58 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.61 -43.21 72.0 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.428 0.455 . . . . 0.0 111.254 176.954 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 54' ' ' VAL . . . . . 0.458 HG21 HD12 ' A' ' 20' ' ' LEU . 50.7 t -72.79 -39.35 59.45 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.987 176.821 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.2 -53.88 53.24 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.781 1.232 . . . . 0.0 114.232 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -69.84 -26.31 64.16 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 119.557 1.071 . . . . 0.0 110.49 -176.733 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -65.03 -53.26 48.81 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.037 0.935 . . . . 0.0 109.387 171.722 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 58' ' ' MET . . . . . 0.749 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 73.3 mtm -64.04 -26.92 68.78 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.51 1.124 . . . . 0.0 111.906 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -66.86 -41.1 87.86 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.564 0.746 . . . . 0.0 110.347 176.768 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -63.45 -40.33 96.85 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.477 0.711 . . . . 0.0 109.939 172.216 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.77 0.65 22.9 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.852 0.861 . . . . 0.0 111.944 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.8 mt 67.96 10.45 7.81 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 125.881 1.672 . . . . 0.0 113.298 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 63' ' ' LYS . . . . . 0.566 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 55.0 mttm -69.24 -44.12 72.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.479 1.112 . . . . 0.0 110.533 177.732 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 64' ' ' VAL . . . . . 0.436 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 26.8 m -123.32 164.41 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.657 0.783 . . . . 0.0 109.778 -178.472 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.2 t -147.03 157.64 43.68 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.723 0.809 . . . . 0.0 109.034 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 66' ' ' LEU . . . . . 0.403 HD12 ' O ' ' A' ' 71' ' ' THR . 30.8 tp -101.5 106.89 18.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -178.187 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.2 p -86.08 -40.39 15.77 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.237 0.615 . . . . 0.0 110.748 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 68' ' ' SER . . . . . 0.437 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 16.0 p -142.21 160.65 54.15 Favored Pre-proline 0 CA--C 1.558 1.285 0 CA-C-O 117.753 -1.118 . . . . 0.0 108.357 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 37.2 Cg_exo -22.97 -70.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.393 2.892 1 C-N-CA 126.099 4.533 . . . . 0.0 117.79 -168.426 . . . . . . . . 3 3 . 1 . 020 nuclear build core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.34 42.08 2.49 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.637 0.775 . . . . 0.0 110.506 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 71' ' ' THR . . . . . 0.403 ' O ' HD12 ' A' ' 66' ' ' LEU . 59.3 m -130.16 125.95 36.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.677 0.791 . . . . 0.0 109.92 -177.747 . . . . . . . . 2 2 . 1 . 020 nuclear build core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -115.5 136.06 53.46 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.652 0.781 . . . . 0.0 109.259 -174.198 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 32.3 t -118.31 171.52 8.08 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.0 tp -68.83 104.75 2.13 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 173.079 . . . . . . . . 1 1 . 1 . 020 nuclear build core ' A' A ' 75' ' ' GLY . . . . . 0.436 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . . . . . . 0 C--N 1.348 1.215 0 O-C-N 123.946 0.779 . . . . 0.0 111.379 -178.212 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.3 mtm . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 001 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 75.68 -64.18 2.62 Favored Glycine 0 N--CA 1.482 1.715 0 C-N-CA 123.541 0.591 . . . . 0.0 113.52 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -55.41 -15.74 2.94 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 125.634 1.574 . . . . 0.0 114.338 178.943 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -69.53 -20.08 63.69 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.831 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -65.35 -19.39 65.93 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.621 0.368 . . . . 0.0 111.068 175.076 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 68.5 m80 -85.83 142.49 28.88 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.565 0.746 . . . . 0.0 109.898 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 70.0 m-70 -98.71 -157.71 0.62 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.864 0.866 . . . . 0.0 110.212 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -91.74 30.06 1.43 Allowed 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 124.892 1.277 . . . . 0.0 111.306 -177.316 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.53 ' HB2' ' NH1' ' A' ' 16' ' ' ARG . 10.2 m 60.13 82.59 0.15 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.414 1.086 . . . . 0.0 109.489 -173.548 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.6 t60 -70.4 -37.59 74.5 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.774 1.23 . . . . 0.0 111.284 -170.205 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.8 mmt -77.2 171.74 14.35 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.845 0.858 . . . . 0.0 110.611 -178.864 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.7 78.98 3.34 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.607 0.763 . . . . 0.0 109.721 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.433 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 31.8 t70 -66.18 119.76 64.45 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.546 -176.235 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 14' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 3.5 Cg_exo -78.14 51.93 3.87 Favored 'Trans proline' 0 C--N 1.386 2.52 0 C-N-CA 124.045 3.163 . . . . 0.0 113.627 -176.364 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 148.43 72.83 0.01 OUTLIER Glycine 0 C--N 1.338 0.67 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 176.956 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.53 ' NH1' ' HB2' ' A' ' 9' ' ' SER . 9.4 tpp180 -56.95 -38.09 72.45 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.112 0.965 . . . . 0.0 112.079 -173.449 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -67.88 -35.13 77.97 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.252 0.621 . . . . 0.0 111.211 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -62.93 -44.44 97.4 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-O 119.446 -0.641 . . . . 0.0 112.855 171.295 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -66.87 -42.9 84.85 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.51 0.671 . . . . 0.0 109.745 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.457 HD11 HD23 ' A' ' 51' ' ' LEU . 2.0 tm? -62.42 -41.41 98.68 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.609 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -64.42 -42.82 95.84 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.673 0.789 . . . . 0.0 110.33 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 99.3 mt-30 -62.31 -36.25 81.57 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.06 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.532 ' O ' HG23 ' A' ' 27' ' ' VAL . 34.9 mmm-85 -64.84 -50.66 65.77 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 123.702 0.626 . . . . 0.0 110.852 175.418 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 80.2 mt -56.63 -50.39 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 124.141 0.9 . . . . 0.0 109.864 -176.269 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.574 HD21 ' HB3' ' A' ' 63' ' ' LYS . 96.1 mt -61.69 -37.84 85.62 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.594 0.758 . . . . 0.0 111.274 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -69.58 -44.47 70.75 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.016 0.926 . . . . 0.0 110.517 -176.981 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 23' ' ' ARG . 94.4 t -60.1 -43.12 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.95 0.9 . . . . 0.0 110.241 176.467 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 80.6 mt -64.48 -34.96 79.42 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.853 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.6 m -74.52 -43.15 57.25 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 123.644 0.778 . . . . 0.0 111.283 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -62.67 -41.57 99.15 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.451 0.7 . . . . 0.0 110.361 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -41.91 92.6 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.976 0.798 . . . . 0.0 110.417 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 63.62 27.61 71.24 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.464 -170.062 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.9 m -159.16 161.74 27.28 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.016 1.326 . . . . 0.0 109.611 -166.873 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -53.84 125.85 20.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 122.802 2.335 . . . . 0.0 113.473 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.476 HG21 HG12 ' A' ' 27' ' ' VAL . 76.8 t -107.37 130.45 59.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.18 0.992 . . . . 0.0 108.392 174.54 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.32 151.59 47.2 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.639 0.776 . . . . 0.0 110.499 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.406 ' O ' HG23 ' A' ' 41' ' ' VAL . 54.5 tp -63.04 -49.01 76.24 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.969 0.907 . . . . 0.0 110.425 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -50.09 -37.6 34.59 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.822 0.849 . . . . 0.0 112.333 170.941 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.424 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 46.3 tt0 -73.95 -36.38 64.62 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.88 -31.51 72.56 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.272 0.629 . . . . 0.0 110.393 178.488 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.518 ' HA ' HD11 ' A' ' 51' ' ' LEU . 45.4 t -57.85 -54.03 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 O-C-N 123.573 0.546 . . . . 0.0 110.717 174.903 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HE3' ' HG3' ' A' ' 39' ' ' GLN . 20.6 pttp -75.13 -39.21 60.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.499 -173.796 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -65.39 -58.21 6.44 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.42 0.688 . . . . 0.0 111.87 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 37.6 m -80.97 -4.36 54.79 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.817 0.447 . . . . 0.0 111.252 -173.717 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 62.08 31.25 17.91 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.12 1.368 . . . . 0.0 111.597 171.219 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -128.47 150.06 73.41 Favored Pre-proline 0 N--CA 1.476 0.873 0 C-N-CA 123.52 0.728 . . . . 0.0 110.344 -175.858 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.2 142.07 71.99 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.458 2.106 . . . . 0.0 111.757 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -43.46 -41.3 4.24 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.769 1.228 . . . . 0.0 112.051 172.893 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -54.09 -51.69 63.36 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.362 1.065 . . . . 0.0 111.625 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -66.49 -44.9 81.36 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.568 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.518 HD11 ' HA ' ' A' ' 41' ' ' VAL . 98.5 mt -54.75 -51.17 66.52 Favored 'General case' 0 C--O 1.212 -0.879 0 O-C-N 124.43 1.081 . . . . 0.0 111.253 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 92.8 m-20 -48.74 -56.75 7.73 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.087 0.955 . . . . 0.0 112.194 -179.127 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -58.93 -41.89 88.46 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 123.997 0.81 . . . . 0.0 112.115 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.506 HG13 HH21 ' A' ' 57' ' ' ARG . 86.1 t -68.95 -48.31 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 122.987 0.515 . . . . 0.0 110.259 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -55.59 -38.29 69.2 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.563 1.545 . . . . 0.0 114.178 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -70.41 -30.78 67.75 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 118.767 0.712 . . . . 0.0 110.792 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.506 HH21 HG13 ' A' ' 54' ' ' VAL . 46.5 ttp180 -71.42 -44.23 65.26 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.858 0.724 . . . . 0.0 109.348 176.389 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.461 ' SD ' HG12 ' A' ' 54' ' ' VAL . 80.5 mtp -63.55 -31.98 73.3 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.335 1.054 . . . . 0.0 111.046 176.0 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.52 -44.92 95.17 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.708 0.803 . . . . 0.0 110.611 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 57' ' ' ARG . 52.7 mttm -63.02 -35.9 81.77 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.623 0.769 . . . . 0.0 110.749 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -85.88 5.25 33.74 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.555 0.742 . . . . 0.0 111.312 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.8 mt 66.36 9.95 6.84 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 125.218 1.407 . . . . 0.0 113.016 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.574 ' HB3' HD21 ' A' ' 25' ' ' LEU . 94.2 mttt -69.11 -35.34 76.32 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.372 1.069 . . . . 0.0 111.094 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.5 m -129.8 158.67 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.613 0.765 . . . . 0.0 109.919 177.586 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.1 m -132.92 152.85 51.83 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.421 1.089 . . . . 0.0 108.075 172.78 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.96 112.77 24.58 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.1 p -87.58 -37.72 16.59 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.12 0.568 . . . . 0.0 111.553 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.624 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 9.2 t -140.59 155.09 69.75 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -176.663 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -26.18 -68.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.391 2.799 0 C-N-CA 125.071 3.847 . . . . 0.0 116.495 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.22 41.35 2.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.186 0.594 . . . . 0.0 110.902 176.138 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.624 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 26.5 m -129.37 125.71 37.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.641 0.776 . . . . 0.0 108.955 174.752 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -108.27 163.83 12.85 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.802 0.841 . . . . 0.0 109.219 -175.691 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.428 ' HA ' HD22 ' A' ' 28' ' ' LEU . 43.9 t -146.3 164.02 33.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 177.195 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.444 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 35.2 tp -68.35 135.38 51.75 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.415 -0.958 . . . . 0.0 108.415 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.89 75.59 0.31 Allowed Glycine 0 C--N 1.351 1.393 0 O-C-N 124.174 0.922 . . . . 0.0 111.608 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 74.28 -82.45 0.78 Allowed Glycine 0 C--N 1.346 1.096 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -171.164 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.9 t -162.11 -160.48 0.68 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.851 1.26 . . . . 0.0 108.01 176.751 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -61.6 126.02 85.85 Favored Pre-proline 0 N--CA 1.474 0.747 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 167.295 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -64.65 98.66 0.3 Allowed 'Trans proline' 0 C--N 1.374 1.878 0 C-N-CA 122.355 2.037 . . . . 0.0 111.196 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 . . . . . 0 CA--C 1.553 1.071 0 C-N-CA 123.474 0.71 . . . . 0.0 109.458 -179.351 . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.8 tpt . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 0 0 . 1 . 002 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.22 45.71 94.94 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.681 -0.691 . . . . 0.0 113.477 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 69.29 162.29 0.22 Allowed 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 124.869 1.268 . . . . 0.0 111.331 -176.255 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -52.45 121.67 7.44 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.234 0.614 . . . . 0.0 109.362 170.039 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -46.17 -51.46 14.08 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.72 1.208 . . . . 0.0 112.135 -170.744 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -162.04 104.62 1.16 Allowed 'General case' 0 C--O 1.236 0.387 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 173.411 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -61.03 92.32 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.726 0.81 . . . . 0.0 109.983 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 56.13 -80.38 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.268 1.427 . . . . 0.0 112.137 179.041 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.9 p -153.18 2.0 0.28 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.324 0.649 . . . . 0.0 111.593 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 67.45 6.3 4.83 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 125.136 1.375 . . . . 0.0 110.607 -169.219 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 56.9 mtt -145.49 -171.93 3.78 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 125.805 1.642 . . . . 0.0 107.743 -172.13 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.83 -174.38 3.49 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 165.272 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 13' ' ' ASP . . . . . 0.596 ' HB2' ' HG2' ' A' ' 16' ' ' ARG . 6.3 m-20 -70.92 134.44 85.71 Favored Pre-proline 0 N--CA 1.484 1.251 0 O-C-N 122.093 -0.379 . . . . 0.0 110.504 177.954 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -62.39 121.19 9.07 Favored 'Trans proline' 0 C--N 1.375 1.956 0 C-N-CA 122.793 2.329 . . . . 0.0 110.988 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 45.82 58.97 5.19 Favored Glycine 0 C--N 1.355 1.601 0 O-C-N 124.338 1.024 . . . . 0.0 114.073 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.596 ' HG2' ' HB2' ' A' ' 13' ' ' ASP . 36.0 mtp-105 -47.73 -60.92 2.22 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.621 1.169 . . . . 0.0 112.848 -172.344 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -65.53 -35.58 81.28 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 123.942 0.776 . . . . 0.0 111.524 -173.639 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.42 -52.76 47.97 Favored Glycine 0 C--N 1.346 1.134 0 N-CA-C 114.371 0.508 . . . . 0.0 114.371 171.68 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -67.27 -36.04 80.76 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.961 0.504 . . . . 0.0 110.155 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.421 ' O ' HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -64.37 -51.88 61.08 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.123 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.29 -47.43 79.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.96 0.904 . . . . 0.0 111.108 -175.444 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -38.11 85.7 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 124.067 0.854 . . . . 0.0 110.739 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.434 ' O ' HG23 ' A' ' 27' ' ' VAL . 14.1 tpp180 -71.83 -38.51 70.15 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 122.986 0.514 . . . . 0.0 110.857 -178.094 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 20' ' ' LEU . 82.5 mt -58.76 -51.76 68.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 122.806 0.443 . . . . 0.0 109.934 174.592 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.409 HD21 ' HB3' ' A' ' 63' ' ' LYS . 98.6 mt -56.1 -43.15 77.82 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 123.672 0.789 . . . . 0.0 110.905 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -61.64 -51.18 69.51 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 124.194 0.934 . . . . 0.0 111.12 -175.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 23' ' ' ARG . 87.7 t -57.82 -41.97 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 124.133 0.896 . . . . 0.0 110.971 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.05 -33.11 71.53 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.252 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.6 m -71.64 -49.43 40.08 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 123.432 0.693 . . . . 0.0 112.12 177.928 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.51 -36.46 82.64 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.21 0.604 . . . . 0.0 110.268 -176.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.62 -38.35 70.81 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.815 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.52 22.98 64.33 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 124.031 0.832 . . . . 0.0 113.342 -176.859 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.6 m -152.62 164.88 18.89 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.149 0.98 . . . . 0.0 109.724 -167.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -58.93 117.09 3.76 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 122.364 2.043 . . . . 0.0 112.509 172.397 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.4 t -111.31 133.2 57.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.625 1.17 . . . . 0.0 108.573 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 59.4 mtpt -68.77 144.58 54.29 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.347 0.659 . . . . 0.0 109.875 177.886 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.478 HD13 HD11 ' A' ' 55' ' ' LEU . 29.1 tp -58.48 -40.44 82.74 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.721 0.638 . . . . 0.0 110.808 176.204 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.02 -44.83 2.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.418 1.087 . . . . 0.0 113.16 167.133 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -81.66 -32.61 31.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.346 0.258 . . . . 0.0 110.536 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.3 mt -58.62 -33.52 70.13 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.666 0.387 . . . . 0.0 110.194 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 37' ' ' LEU . 99.0 t -52.8 -58.8 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.78 0.832 . . . . 0.0 112.285 173.49 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -70.5 -40.96 73.27 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -69.33 -43.58 73.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 82.0 m -77.77 -15.47 59.08 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 61.28 26.15 16.03 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.786 0.835 . . . . 0.0 110.296 -173.698 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.91 143.75 31.4 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 124.124 0.969 . . . . 0.0 110.081 -171.652 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.66 138.32 41.23 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.583 2.189 . . . . 0.0 111.615 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -47.99 -30.3 4.19 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.218 1.407 . . . . 0.0 112.721 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 mtm180 -56.45 -56.69 18.01 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.143 0.977 . . . . 0.0 111.136 174.871 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.5 mp0 -66.23 -43.01 87.82 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.21 -177.493 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.7 mt -54.74 -52.9 61.07 Favored 'General case' 0 C--O 1.209 -1.048 0 O-C-N 124.448 1.093 . . . . 0.0 110.098 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 76.3 m-20 -47.53 -58.9 3.67 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.283 1.033 . . . . 0.0 112.08 176.363 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.9 mt-30 -53.51 -50.88 64.48 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.226 1.01 . . . . 0.0 112.339 -177.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.29 -43.68 84.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 C-N-CA 123.147 0.579 . . . . 0.0 111.462 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.478 HD11 HD13 ' A' ' 37' ' ' LEU . 27.8 mt -48.19 -48.5 34.66 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.992 1.317 . . . . 0.0 114.265 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -72.48 -25.62 61.49 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.392 0.996 . . . . 0.0 111.86 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -70.31 -55.34 9.42 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.459 ' HB2' ' HB2' ' A' ' 63' ' ' LYS . 18.0 ptm -67.99 -23.85 65.07 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.922 -178.29 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.2 tttm -69.15 -43.1 74.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.608 0.763 . . . . 0.0 110.72 171.663 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.407 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -59.19 -37.88 78.48 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.98 0.912 . . . . 0.0 110.577 175.298 . . . . . . . . 3 3 . 1 . 002 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -86.21 -0.49 55.87 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 115.056 -0.975 . . . . 0.0 112.038 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.3 mt 60.8 24.72 14.62 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.068 1.347 . . . . 0.0 112.688 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 58' ' ' MET . 55.1 mttm -67.5 -32.13 72.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.505 1.122 . . . . 0.0 109.569 168.25 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.458 HG22 ' HG3' ' A' ' 58' ' ' MET . 28.1 m -133.37 160.79 42.17 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.558 171.719 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.1 m -129.85 156.46 44.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 171.541 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.4 tp -103.07 112.4 25.22 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.9 p -94.9 -43.82 8.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.696 0.399 . . . . 0.0 111.23 -174.597 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.694 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 19.6 m -132.93 162.34 58.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.478 0.711 . . . . 0.0 110.183 -175.274 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.6 115.86 2.75 Favored 'Trans proline' 0 C--N 1.379 2.175 0 C-N-CA 122.972 2.448 . . . . 0.0 112.247 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 70.54 9.89 7.02 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.42 1.488 . . . . 0.0 112.386 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.694 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 28.0 m -124.58 121.77 35.7 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.258 0.623 . . . . 0.0 109.418 -174.501 . . . . . . . . 2 2 . 1 . 002 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -107.67 165.83 11.14 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.272 1.029 . . . . 0.0 109.591 -172.306 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 52.2 t -146.15 158.58 43.88 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 43.5 tp -69.46 138.35 53.38 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.477 0.486 . . . . 0.0 110.186 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -79.32 71.13 2.7 Favored Glycine 0 C--N 1.343 0.969 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 176.116 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.85 -79.43 0.48 Allowed Glycine 0 C--N 1.35 1.347 0 N-CA-C 111.779 -0.528 . . . . 0.0 111.779 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.4 t -154.76 13.07 0.4 Allowed 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.515 1.126 . . . . 0.0 110.525 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.4 t70 62.49 85.12 0.18 Allowed Pre-proline 0 N--CA 1.483 1.223 0 C-N-CA 124.184 0.994 . . . . 0.0 109.218 -165.296 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.73 -25.18 12.7 Favored 'Trans proline' 0 C--N 1.376 1.979 0 C-N-CA 122.491 2.127 . . . . 0.0 113.259 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 119.112 -0.471 . . . . 0.0 109.981 -173.175 . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 . . . . . . . . . 0 0 . 1 . 003 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -59.32 112.37 4.19 Favored Glycine 0 C--N 1.355 1.627 0 O-C-N 124.322 1.014 . . . . 0.0 112.832 -178.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 -145.76 8.71 1.14 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 122.912 0.485 . . . . 0.0 112.226 -177.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -66.49 106.18 1.69 Allowed 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.053 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.539 ' HA ' ' OG ' ' A' ' 9' ' ' SER . 95.8 m-70 -72.86 72.08 1.07 Allowed 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.014 0.925 . . . . 0.0 112.027 -172.562 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -153.4 50.97 0.71 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 125.727 1.611 . . . . 0.0 107.273 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 82.3 t60 68.39 6.58 5.44 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 124.715 1.206 . . . . 0.0 111.345 -174.318 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -125.47 31.71 5.49 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.859 0.864 . . . . 0.0 109.915 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.539 ' OG ' ' HA ' ' A' ' 5' ' ' HIS . 17.7 m -79.2 22.26 0.42 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.446 0.698 . . . . 0.0 111.885 177.107 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -150.41 157.44 43.04 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 125.186 1.394 . . . . 0.0 107.752 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 14.1 tpt -91.07 90.33 7.79 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.474 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.53 94.57 0.19 Allowed 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.64 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 65.87 116.07 0.03 OUTLIER Pre-proline 0 CA--C 1.556 1.174 0 O-C-N 124.887 1.367 . . . . 0.0 109.971 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -72.5 32.91 0.29 Allowed 'Trans proline' 0 N--CA 1.5 1.906 0 C-N-CA 123.459 2.772 . . . . 0.0 114.481 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -50.29 -59.76 7.37 Favored Glycine 0 C--N 1.355 1.586 0 N-CA-C 115.134 0.814 . . . . 0.0 115.134 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -64.46 -43.42 94.28 Favored 'General case' 0 C--N 1.358 0.951 0 CA-C-N 117.573 0.686 . . . . 0.0 112.408 -176.425 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -66.25 -41.21 90.3 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 122.838 0.455 . . . . 0.0 111.93 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.05 -29.13 72.39 Favored Glycine 0 C--N 1.343 0.929 0 O-C-N 123.996 0.81 . . . . 0.0 112.592 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -84.01 -31.89 25.21 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD11 HD23 ' A' ' 51' ' ' LEU . 2.4 tm? -65.16 -42.29 93.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.322 1.049 . . . . 0.0 109.059 172.005 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -62.88 -43.57 98.44 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.1 1.36 . . . . 0.0 109.444 173.601 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.1 tm0? -60.81 -44.12 97.29 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.006 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.417 ' O ' HG23 ' A' ' 27' ' ' VAL . 27.7 tpt180 -68.47 -43.29 77.28 Favored 'General case' 0 C--N 1.347 0.483 0 O-C-N 123.685 0.616 . . . . 0.0 111.141 -177.109 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 84.7 mt -57.07 -50.33 76.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.88 -32.5 74.04 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.503 0.721 . . . . 0.0 111.29 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 20.2 tp60 -68.93 -45.27 71.22 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 123.003 0.521 . . . . 0.0 110.1 -179.708 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 23' ' ' ARG . 80.5 t -62.06 -36.79 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.386 0.674 . . . . 0.0 110.303 177.471 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 96.2 mt -66.14 -39.91 90.2 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.552 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 62.6 m -72.03 -48.6 43.36 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.328 1.051 . . . . 0.0 111.984 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.8 mm-40 -68.65 -34.85 76.43 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 118.085 0.402 . . . . 0.0 111.141 -175.251 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.07 -39.36 90.02 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.351 170.628 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.12 23.03 59.09 Favored Glycine 0 C--N 1.356 1.659 0 O-C-N 123.86 0.725 . . . . 0.0 112.321 -174.401 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -153.43 150.15 22.91 Favored Pre-proline 0 C--O 1.24 0.569 0 C-N-CA 124.574 1.15 . . . . 0.0 108.346 -169.398 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.594 ' HB3' ' SG ' ' A' ' 73' ' ' CYS . 6.1 Cg_endo -48.53 112.77 0.67 Allowed 'Trans proline' 0 C--N 1.375 1.969 0 C-N-CA 123.804 3.002 . . . . 0.0 113.026 175.918 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 85.4 t -96.82 136.72 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -77.53 155.93 31.29 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.462 ' O ' HG23 ' A' ' 41' ' ' VAL . 23.0 tp -64.27 -46.23 84.58 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.045 0.938 . . . . 0.0 109.122 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.31 -44.37 33.87 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 0.0 112.48 168.389 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.69 -32.34 65.71 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 117.953 0.342 . . . . 0.0 110.363 179.001 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.6 mt -62.15 -35.63 79.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.849 0.459 . . . . 0.0 110.198 176.76 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 37' ' ' LEU . 61.2 t -56.06 -54.7 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.353 0.661 . . . . 0.0 111.563 177.261 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -71.98 -45.81 59.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.527 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.44 -39.62 94.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 68.5 m -82.24 -18.54 42.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 119.242 -0.408 . . . . 0.0 111.426 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 59.11 31.55 21.39 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.831 0.852 . . . . 0.0 109.905 -173.048 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.28 146.79 45.5 Favored Pre-proline 0 C--O 1.241 0.642 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.239 -169.038 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -63.76 129.41 24.74 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 122.802 2.335 . . . . 0.0 112.391 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -51.78 -28.67 16.16 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 124.341 1.026 . . . . 0.0 112.925 177.588 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.3 mtm180 -53.96 -57.03 12.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.525 0.73 . . . . 0.0 110.392 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.423 ' O ' HG23 ' A' ' 54' ' ' VAL . 1.1 mp0 -66.75 -44.45 81.47 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.768 -175.705 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.482 HD23 HD11 ' A' ' 20' ' ' LEU . 92.2 mt -55.71 -56.38 21.08 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 124.208 0.942 . . . . 0.0 110.401 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -48.7 -53.11 20.11 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.798 1.239 . . . . 0.0 111.374 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -52.15 -56.89 11.67 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 124.1 0.96 . . . . 0.0 112.619 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.664 HG12 ' SD ' ' A' ' 58' ' ' MET . 60.7 t -66.68 -35.56 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.001 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.3 mt -52.15 -48.79 64.72 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.479 1.111 . . . . 0.0 113.262 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -73.88 -25.18 59.9 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 118.253 0.479 . . . . 0.0 110.782 -175.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -67.59 -52.28 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.587 0.755 . . . . 0.0 109.418 172.309 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.664 ' SD ' HG12 ' A' ' 54' ' ' VAL . 70.7 mtp -59.74 -26.58 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.489 1.116 . . . . 0.0 111.368 176.007 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -70.99 -37.2 72.71 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.777 0.431 . . . . 0.0 110.167 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.31 -30.67 68.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.088 0.555 . . . . 0.0 110.412 173.247 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -77.62 -5.66 51.09 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.267 0.627 . . . . 0.0 111.271 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 55.4 mt 68.13 17.58 9.41 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.884 1.274 . . . . 0.0 111.037 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -81.75 -28.67 33.21 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.889 1.276 . . . . 0.0 111.803 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 32.9 m -130.86 158.8 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.225 0.61 . . . . 0.0 109.665 174.825 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.5 m -143.65 149.45 37.28 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -101.28 108.54 20.21 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.428 HG21 ' SG ' ' A' ' 73' ' ' CYS . 33.7 p -99.04 -32.21 11.39 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.25 0.548 . . . . 0.0 111.093 -176.375 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.564 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 35.8 t -140.22 153.83 69.36 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -43.67 114.18 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.519 0 C-N-CA 123.549 2.833 . . . . 0.0 114.011 175.155 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 59.8 26.89 16.11 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.753 1.221 . . . . 0.0 112.117 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.564 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 41.9 m -130.88 125.33 33.28 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 123.259 0.624 . . . . 0.0 109.516 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -117.44 146.53 43.41 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.023 0.929 . . . . 0.0 109.205 -170.795 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.594 ' SG ' ' HB3' ' A' ' 34' ' ' PRO . 78.4 m -113.68 158.66 20.59 Favored 'General case' 0 C--O 1.25 1.115 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.431 . . . . . . . . 2 2 . 1 . 003 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 33.1 tp -64.97 102.31 0.6 Allowed 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.988 174.04 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -82.94 -31.75 28.29 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.945 178.331 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -98.99 170.2 23.58 Favored Glycine 0 C--N 1.346 1.123 0 C-N-CA 122.969 0.319 . . . . 0.0 112.481 -174.552 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 26.6 m -91.66 72.03 5.84 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-O 121.942 0.877 . . . . 0.0 109.837 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.33 -51.69 9.71 Favored Pre-proline 0 CA--C 1.559 1.324 0 CA-C-N 114.588 -1.187 . . . . 0.0 113.013 177.774 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -65.43 -21.7 60.27 Favored 'Trans proline' 0 C--N 1.38 2.216 0 C-N-CA 122.24 1.96 . . . . 0.0 113.72 -172.945 . . . . . . . . 1 1 . 1 . 003 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -175.999 . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 004 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.24 90.25 0.22 Allowed Glycine 0 C--N 1.351 1.366 0 CA-C-O 119.987 -0.34 . . . . 0.0 112.971 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 70.04 147.26 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 125.867 1.667 . . . . 0.0 112.193 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.6 p-80 -141.01 151.06 43.82 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.55 1.14 . . . . 0.0 108.882 174.011 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -158.62 102.98 1.72 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.124 0.569 . . . . 0.0 110.66 176.527 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -135.69 -10.9 2.09 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.71 0.804 . . . . 0.0 110.727 171.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -143.66 -152.53 0.42 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.723 0.809 . . . . 0.0 109.359 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 68.32 -87.31 0.03 OUTLIER 'General case' 0 C--N 1.364 1.207 0 C-N-CA 124.993 1.317 . . . . 0.0 111.13 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.483 ' HB3' ' NE2' ' A' ' 22' ' ' GLN . 66.8 m -78.08 -16.12 58.3 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.961 0.505 . . . . 0.0 111.465 -176.164 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -143.72 87.25 1.91 Allowed 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.0 ptt? -147.28 105.53 3.77 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.417 1.087 . . . . 0.0 108.153 178.542 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.06 175.5 0.2 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.402 1.081 . . . . 0.0 111.593 -172.053 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 70.54 132.39 0.04 OUTLIER Pre-proline 0 N--CA 1.489 1.507 0 C-N-CA 125.307 1.443 . . . . 0.0 112.024 173.739 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_exo -54.59 -43.79 55.66 Favored 'Trans proline' 0 C--N 1.377 2.043 0 C-N-CA 122.492 2.128 . . . . 0.0 110.922 167.727 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 40.58 48.43 3.91 Favored Glycine 0 C--N 1.36 1.866 0 O-C-N 125.324 1.64 . . . . 0.0 114.35 171.322 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.444 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 79.4 mtp180 -57.7 -47.81 81.31 Favored 'General case' 0 C--O 1.215 -0.756 0 C-N-CA 123.976 0.911 . . . . 0.0 112.472 -163.8 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -69.17 -48.54 61.95 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.272 0.629 . . . . 0.0 111.618 -174.873 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.18 -39.34 94.38 Favored Glycine 0 C--N 1.344 1.024 0 O-C-N 123.351 0.407 . . . . 0.0 113.683 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -77.77 -30.95 51.7 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.702 0.401 . . . . 0.0 110.209 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.536 HD22 ' SG ' ' A' ' 44' ' ' CYS . 3.0 tm? -60.92 -46.99 88.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.839 1.256 . . . . 0.0 109.529 173.419 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.672 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 21.0 tt0 -58.19 -51.6 69.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.799 1.24 . . . . 0.0 110.352 177.835 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.483 ' NE2' ' HB3' ' A' ' 9' ' ' SER . 95.0 mt-30 -63.95 -34.66 78.48 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.68 -174.394 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -68.66 -46.15 69.88 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.078 0.551 . . . . 0.0 112.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.5 mt -59.33 -50.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 122.753 0.421 . . . . 0.0 110.111 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.9 mt -64.87 -31.89 73.33 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.317 0.647 . . . . 0.0 110.636 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.474 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 31.7 tt0 -68.68 -47.95 65.17 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.103 0.561 . . . . 0.0 110.14 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.58 -36.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.246 1.018 . . . . 0.0 110.848 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 89.1 mt -67.48 -40.29 85.28 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.644 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 53.1 m -66.12 -48.04 72.15 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.015 0.926 . . . . 0.0 111.428 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 21.9 mm-40 -67.91 -38.94 83.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.457 0.703 . . . . 0.0 111.575 -174.471 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.52 96.14 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.877 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.96 28.57 72.21 Favored Glycine 0 C--N 1.351 1.389 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.057 -172.69 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.2 m -153.8 158.55 32.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 124.428 1.091 . . . . 0.0 109.029 -169.223 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -60.49 122.03 10.66 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.219 1.946 . . . . 0.0 112.106 169.982 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.3 t -107.74 130.68 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.432 1.093 . . . . 0.0 108.756 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.601 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.6 mttt -66.81 152.53 45.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 122.966 0.506 . . . . 0.0 110.837 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.498 ' O ' HG23 ' A' ' 41' ' ' VAL . 27.6 tp -59.72 -45.27 92.67 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 123.949 0.781 . . . . 0.0 109.817 174.221 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.33 -42.69 2.28 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.909 1.283 . . . . 0.0 113.818 168.303 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -84.68 -29.79 25.34 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.64 -33.03 74.2 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.728 0.411 . . . . 0.0 110.201 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.512 ' HA ' HD11 ' A' ' 51' ' ' LEU . 42.8 t -59.46 -55.15 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.56 0.744 . . . . 0.0 111.716 175.442 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -71.93 -39.58 69.35 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.456 -174.777 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -67.32 -50.53 59.71 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.947 0.499 . . . . 0.0 111.92 177.302 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.536 ' SG ' HD22 ' A' ' 20' ' ' LEU . 10.0 t -79.11 -12.85 60.01 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.842 0.457 . . . . 0.0 110.911 -175.584 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 61.78 28.97 17.84 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.818 1.247 . . . . 0.0 111.868 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -122.14 155.59 61.16 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 123.953 0.901 . . . . 0.0 111.367 -172.651 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.64 129.44 23.63 Favored 'Trans proline' 0 C--N 1.381 2.28 0 C-N-CA 122.169 1.912 . . . . 0.0 111.548 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.528 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.9 ttmt -45.26 -41.01 8.09 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 124.722 1.209 . . . . 0.0 113.027 175.961 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -54.14 -46.92 72.35 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.269 1.027 . . . . 0.0 112.031 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -66.5 -43.49 85.16 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.652 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 48' ' ' LYS . 85.2 mt -56.83 -52.02 66.71 Favored 'General case' 0 C--N 1.358 0.974 0 O-C-N 124.227 0.954 . . . . 0.0 111.252 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -48.47 -55.89 9.73 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.625 1.17 . . . . 0.0 111.966 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -60.56 -41.6 94.89 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.79 -174.89 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.4 t -69.56 -44.11 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 122.497 0.319 . . . . 0.0 110.299 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.401 HD13 ' NE1' ' A' ' 72' ' ' TRP . 35.4 mt -50.68 -49.49 57.21 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.917 1.287 . . . . 0.0 113.254 178.857 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.428 ' O ' ' HG2' ' A' ' 60' ' ' LYS . 69.1 m-85 -70.4 -27.55 64.38 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 119.038 0.835 . . . . 0.0 111.33 -177.001 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -72.26 -44.74 62.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.333 0.653 . . . . 0.0 109.496 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.672 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 71.5 mtm -64.49 -31.12 72.19 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.54 0.736 . . . . 0.0 111.217 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -66.61 -35.19 79.6 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.17 0.988 . . . . 0.0 110.974 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 56' ' ' TYR . 74.3 mmtt -57.51 -36.8 72.02 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.493 0.717 . . . . 0.0 111.14 170.932 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -90.55 5.1 49.2 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.321 1.048 . . . . 0.0 111.174 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 61.26 20.37 10.97 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.484 1.514 . . . . 0.0 112.798 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 95.2 mttt -70.68 -38.96 73.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.703 0.801 . . . . 0.0 110.637 176.422 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.5 m -125.04 154.21 32.89 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 C-N-CA 123.778 0.831 . . . . 0.0 109.356 175.163 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -138.88 143.88 38.94 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.405 1.082 . . . . 0.0 108.594 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.22 105.14 17.25 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -173.548 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.8 p -87.25 -36.92 17.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.706 0.802 . . . . 0.0 111.578 -173.635 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.541 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 27.7 m -137.14 163.79 46.68 Favored Pre-proline 0 CA--C 1.551 0.986 0 CA-C-O 117.526 -1.226 . . . . 0.0 107.709 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.414 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 25.6 Cg_exo -20.37 -63.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.399 3.205 1 C-N-CA 125.967 4.445 . . . . 0.0 116.785 -176.265 . . . . . . . . 3 3 . 1 . 004 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.77 10.39 8.97 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.228 0.611 . . . . 0.0 112.061 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.601 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 26.5 m -85.41 126.95 34.19 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.87 0.366 . . . . 0.0 110.562 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.401 ' NE1' HD13 ' A' ' 55' ' ' LEU . 90.7 m95 -108.15 166.17 10.94 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.549 1.14 . . . . 0.0 109.402 -177.865 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 47.4 t -150.17 157.22 42.87 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.585 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 29.3 tp -79.31 112.76 16.86 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.32 -38.39 91.42 Favored Glycine 0 CA--C 1.528 0.871 0 O-C-N 123.816 0.698 . . . . 0.0 112.336 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -153.69 134.41 4.36 Favored Glycine 0 C--N 1.349 1.251 0 CA-C-O 119.536 -0.591 . . . . 0.0 111.959 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.526 ' HA ' HD21 ' A' ' 74' ' ' LEU . 27.8 m -71.94 122.28 20.54 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.044 0.537 . . . . 0.0 109.853 178.018 . . . . . . . . 2 2 . 1 . 004 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -82.5 112.44 36.77 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 176.067 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -88.4 -158.68 0.08 OUTLIER 'Trans proline' 0 C--N 1.373 1.859 0 C-N-CA 122.617 2.211 . . . . 0.0 110.765 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 . . . . . 0 C--O 1.251 1.171 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 173.874 . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.2 mtt . . . . . 0 N--CA 1.479 0.981 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 005 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.52 -22.1 61.08 Favored Glycine 0 C--N 1.355 1.59 0 O-C-N 123.633 0.583 . . . . 0.0 113.867 -177.293 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -77.05 13.68 1.04 Allowed 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 124.217 1.007 . . . . 0.0 111.692 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -53.61 -52.24 60.47 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 122.987 0.515 . . . . 0.0 110.801 172.872 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 76.1 t60 58.25 -1.93 0.09 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.246 1.418 . . . . 0.0 114.706 171.645 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -70.58 -23.61 62.62 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.718 0.807 . . . . 0.0 111.794 -168.864 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -70.6 103.75 2.61 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.115 0.566 . . . . 0.0 109.492 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -164.97 41.56 0.08 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.121 0.969 . . . . 0.0 110.001 176.315 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.8 m -70.03 -15.12 62.97 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.401 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -78.58 -3.78 45.53 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.344 0.658 . . . . 0.0 111.251 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.6 mtt -79.32 -1.8 38.51 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 122.084 -0.385 . . . . 0.0 111.558 172.109 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -162.25 89.19 0.69 Allowed 'General case' 0 C--N 1.35 0.602 0 C-N-CA 124.313 1.045 . . . . 0.0 109.925 174.41 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -157.41 81.61 3.17 Favored Pre-proline 0 CA--C 1.553 1.087 0 C-N-CA 123.258 0.623 . . . . 0.0 111.304 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -88.45 27.25 0.54 Allowed 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 123.025 2.483 . . . . 0.0 112.968 179.089 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 55.73 -171.35 1.8 Allowed Glycine 0 N--CA 1.477 1.381 0 CA-C-N 115.597 -0.729 . . . . 0.0 113.735 -172.665 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.405 HH21 ' HG2' ' A' ' 50' ' ' GLU . 57.0 ttp180 -65.72 -10.07 33.46 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.872 0.869 . . . . 0.0 113.049 165.081 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -51.1 -51.18 55.88 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -162.882 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.35 -27.88 73.35 Favored Glycine 0 N--CA 1.472 1.056 0 O-C-N 123.419 0.449 . . . . 0.0 114.008 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -75.74 -38.0 58.85 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.617 0.767 . . . . 0.0 110.288 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD12 HG21 ' A' ' 54' ' ' VAL . 2.6 tm? -64.3 -41.63 96.77 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.058 0.943 . . . . 0.0 109.976 175.154 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 43.0 tt0 -63.52 -40.61 97.49 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.123 0.969 . . . . 0.0 110.422 173.785 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.52 -36.97 84.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.9 177.544 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.439 ' O ' HG23 ' A' ' 27' ' ' VAL . 1.3 mmp_? -62.07 -50.4 72.11 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.193 0.597 . . . . 0.0 110.961 172.937 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.2 mt -56.64 -47.97 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.024 0.828 . . . . 0.0 110.442 -176.561 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.605 HD21 ' HB3' ' A' ' 63' ' ' LYS . 78.1 mt -60.54 -46.81 88.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.515 0.726 . . . . 0.0 111.57 178.997 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -66.21 -43.18 87.45 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 123.668 0.605 . . . . 0.0 111.116 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 23' ' ' ARG . 70.9 t -61.02 -46.27 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.443 0.697 . . . . 0.0 110.163 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.46 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.8 mt -66.81 -29.74 69.75 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.677 -179.332 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.506 ' HA ' HD22 ' A' ' 74' ' ' LEU . 89.3 m -72.33 -49.77 31.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.717 0.807 . . . . 0.0 111.725 176.632 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.81 -32.25 72.68 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.107 0.563 . . . . 0.0 110.992 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.75 -41.17 88.22 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.312 0.645 . . . . 0.0 110.89 169.311 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.45 23.35 64.6 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.941 -172.869 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -158.57 158.73 29.69 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 125.221 1.408 . . . . 0.0 109.091 -167.745 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 73' ' ' CYS . 19.4 Cg_endo -60.34 128.32 25.81 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.512 2.141 . . . . 0.0 112.253 172.94 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.8 t -106.54 140.07 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 124.425 1.09 . . . . 0.0 108.201 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -74.46 157.97 34.65 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 123.5 0.72 . . . . 0.0 110.854 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 34.3 tp -68.13 -44.9 75.05 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.355 1.062 . . . . 0.0 111.068 -174.114 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.12 -34.83 10.42 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 168.969 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.482 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 49.6 tt0 -85.91 -29.45 23.62 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.93 -25.95 68.37 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.677 0.391 . . . . 0.0 110.331 176.309 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.659 ' HA ' HD11 ' A' ' 51' ' ' LEU . 60.0 t -64.22 -51.43 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 122.991 0.516 . . . . 0.0 110.474 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -74.95 -47.16 30.9 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.603 0.565 . . . . 0.0 111.612 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.482 ' HG2' ' HG2' ' A' ' 39' ' ' GLN . 46.5 mm-40 -61.54 -49.41 76.82 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 59.1 m -82.1 -8.96 59.68 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 56.92 46.55 19.39 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.698 1.199 . . . . 0.0 111.955 176.94 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.36 146.8 26.28 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.778 178.543 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -54.72 150.04 38.01 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.116 2.544 . . . . 0.0 112.998 172.46 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.494 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.1 ttmt -50.29 -34.67 24.32 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.86 1.264 . . . . 0.0 111.99 175.834 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -53.29 -48.93 67.95 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.166 0.987 . . . . 0.0 112.009 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.405 ' HG2' HH21 ' A' ' 16' ' ' ARG . 1.9 mp0 -66.25 -47.05 75.01 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.46 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.659 HD11 ' HA ' ' A' ' 41' ' ' VAL . 41.9 mt -59.84 -58.83 6.85 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.572 -173.549 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -52.66 -52.86 53.9 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 124.632 1.207 . . . . 0.0 112.074 -174.635 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.18 -37.07 76.48 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.028 0.83 . . . . 0.0 111.614 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.482 HG21 HD12 ' A' ' 20' ' ' LEU . 87.9 t -73.09 -41.98 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 173.351 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.7 -37.21 78.21 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.405 1.082 . . . . 0.0 113.693 -175.7 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -73.21 -27.64 61.73 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 118.652 0.66 . . . . 0.0 110.691 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.408 HH21 ' CD ' ' A' ' 21' ' ' GLU . 4.1 ptt180 -70.79 -44.97 65.53 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.201 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.476 ' HB3' ' HB2' ' A' ' 63' ' ' LYS . 92.6 mtp -66.88 -37.88 85.25 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 124.419 1.088 . . . . 0.0 111.116 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.4 -38.62 90.51 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.678 0.391 . . . . 0.0 110.338 178.599 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.97 -27.63 67.61 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.663 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -91.33 8.73 34.67 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.983 0.913 . . . . 0.0 112.39 176.954 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 63.44 17.16 10.12 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 123.806 0.842 . . . . 0.0 112.263 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.605 ' HB3' HD21 ' A' ' 25' ' ' LEU . 98.3 mttt -82.27 -34.91 28.54 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 124.124 0.97 . . . . 0.0 111.4 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.439 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 18.8 m -132.85 162.53 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.227 0.611 . . . . 0.0 109.997 176.845 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.6 m -131.06 142.95 50.34 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.411 0.684 . . . . 0.0 109.543 175.619 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 41.8 tp -92.51 101.08 13.52 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 175.755 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 31.9 p -85.13 -37.25 20.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.835 0.854 . . . . 0.0 111.667 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.513 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 15.9 t -140.32 155.1 70.3 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_exo -26.84 -59.51 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.52 1 C-N-CA 125.356 4.037 . . . . 0.0 116.865 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -120.05 42.06 3.03 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 111.178 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.513 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 34.1 m -131.95 126.7 34.69 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 123.239 0.616 . . . . 0.0 109.657 174.969 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -120.87 140.77 51.33 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.228 1.011 . . . . 0.0 109.064 -172.842 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 50.8 t -117.9 162.74 17.63 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 123.833 0.853 . . . . 0.0 110.168 -175.962 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 29' ' ' THR . 41.3 tp -69.78 105.69 2.85 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 172.6 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.439 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . -77.12 -43.39 16.83 Favored Glycine 0 C--N 1.335 0.502 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 171.723 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 169.86 113.65 0.29 Allowed Glycine 0 C--N 1.345 1.03 0 CA-C-N 115.031 -0.584 . . . . 0.0 112.172 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.534 ' HA ' HD22 ' A' ' 25' ' ' LEU . 86.4 m -66.16 97.02 0.36 Allowed 'General case' 0 C--O 1.242 0.681 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.848 . . . . . . . . 2 2 . 1 . 005 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.5 t70 64.82 78.24 0.27 Allowed Pre-proline 0 CA--C 1.555 1.142 0 O-C-N 124.498 1.124 . . . . 0.0 109.483 -175.11 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -75.49 159.4 39.62 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.54 2.16 . . . . 0.0 112.786 -177.653 . . . . . . . . 1 1 . 1 . 005 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 . . . . . 0 C--O 1.248 0.976 0 C-N-CA 123.995 0.918 . . . . 0.0 109.975 178.98 . . . . . . . . 0 0 . 1 . 006 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.406 ' SD ' ' N ' ' A' ' 2' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 111.393 0.145 . . . . 0.0 111.393 . . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.406 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -111.94 -55.89 0.47 Allowed Glycine 0 C--N 1.352 1.437 0 N-CA-C 112.289 -0.325 . . . . 0.0 112.289 -176.596 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -67.12 106.87 2.11 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.071 0.948 . . . . 0.0 110.634 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 63.15 52.22 2.56 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 124.321 1.013 . . . . 0.0 109.356 -174.716 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -63.2 122.59 16.52 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.314 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 18.6 p80 -95.43 -41.32 9.04 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.283 0.633 . . . . 0.0 109.988 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -142.03 153.36 44.18 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.998 0.919 . . . . 0.0 109.004 178.015 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 26.8 p80 -76.07 87.74 2.98 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-O 122.059 0.933 . . . . 0.0 109.583 175.715 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 43.1 t -152.64 139.15 18.64 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.152 0.981 . . . . 0.0 110.401 -177.527 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -85.03 -77.25 0.29 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.866 0.866 . . . . 0.0 109.348 174.219 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 67.1 mtt -147.45 -73.63 0.2 Allowed 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.235 1.014 . . . . 0.0 108.413 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.5 -41.38 7.79 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.039 0.936 . . . . 0.0 109.66 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 69.32 168.96 0.12 Allowed Pre-proline 0 N--CA 1.49 1.55 0 C-N-CA 124.679 1.192 . . . . 0.0 111.431 178.698 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -69.55 11.75 0.36 Allowed 'Trans proline' 0 C--N 1.394 2.968 0 C-N-CA 122.933 2.422 . . . . 0.0 114.353 -175.499 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 63.22 158.71 0.18 Allowed Glycine 0 C--N 1.35 1.314 0 N-CA-C 114.459 0.543 . . . . 0.0 114.459 -172.023 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.476 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 99.7 mtt180 -62.1 -36.92 83.17 Favored 'General case' 0 C--O 1.215 -0.739 0 O-C-N 122.626 -0.337 . . . . 0.0 110.537 172.872 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.06 -45.8 63.12 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 123.717 0.636 . . . . 0.0 112.363 -177.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.09 -36.84 94.01 Favored Glycine 0 C--N 1.348 1.224 0 N-CA-C 113.747 0.259 . . . . 0.0 113.747 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -71.58 -39.26 70.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.68 0.392 . . . . 0.0 110.287 177.237 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 51' ' ' LEU . 2.0 tm? -63.24 -46.5 86.64 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.758 1.223 . . . . 0.0 109.566 177.625 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.51 -47.18 82.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.624 1.169 . . . . 0.0 110.306 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -63.21 -39.04 93.5 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.454 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.458 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -64.59 -43.27 94.35 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.0 0.52 . . . . 0.0 110.237 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 20' ' ' LEU . 87.5 mt -58.43 -52.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 123.977 0.798 . . . . 0.0 110.076 177.04 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' A' ' 63' ' ' LYS . 96.0 mt -56.8 -38.45 72.58 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.599 0.76 . . . . 0.0 111.01 -178.058 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -65.17 -48.91 71.83 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.316 1.01 . . . . 0.0 110.99 -178.885 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 23' ' ' ARG . 93.5 t -57.55 -41.71 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.596 0.758 . . . . 0.0 110.825 177.999 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 85.4 mt -63.95 -38.92 92.84 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.953 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.2 m -69.69 -46.12 66.76 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 123.616 0.766 . . . . 0.0 111.495 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.19 -38.31 90.65 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.527 0.731 . . . . 0.0 110.942 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.38 -44.19 83.78 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.509 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 20.19 66.89 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.194 -173.053 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 54.9 p -159.92 153.79 19.48 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.915 1.286 . . . . 0.0 109.155 -168.647 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.48 123.53 9.38 Favored 'Trans proline' 0 C--N 1.378 2.114 0 C-N-CA 123.65 2.9 . . . . 0.0 114.155 -178.368 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.3 t -108.51 129.73 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 124.626 1.171 . . . . 0.0 108.611 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 61.0 mttp -70.52 153.55 42.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.994 0.518 . . . . 0.0 110.66 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.474 ' O ' HG23 ' A' ' 41' ' ' VAL . 53.5 tp -59.76 -48.11 83.0 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 123.885 0.74 . . . . 0.0 109.993 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.31 -41.64 19.56 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.576 1.15 . . . . 0.0 113.071 170.146 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 53.4 tt0 -73.29 -37.68 66.14 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 122.933 0.493 . . . . 0.0 110.734 178.752 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.41 -34.97 73.11 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.361 0.664 . . . . 0.0 110.466 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 37' ' ' LEU . 35.9 t -56.88 -56.64 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.642 0.777 . . . . 0.0 111.711 176.365 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -69.29 -37.96 78.08 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 123.726 0.641 . . . . 0.0 111.735 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 29.7 mm-40 -63.75 -55.82 20.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.098 0.559 . . . . 0.0 111.911 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 41.8 t -76.95 -18.43 58.25 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 122.778 0.431 . . . . 0.0 110.792 -174.457 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 62.21 23.78 14.1 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.942 1.297 . . . . 0.0 110.996 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.19 153.15 49.77 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.554 1.142 . . . . 0.0 109.829 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.487 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 10.5 Cg_endo -54.37 131.16 43.72 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.032 2.488 . . . . 0.0 112.45 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -42.51 -44.89 4.28 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.168 1.387 . . . . 0.0 113.488 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.412 ' HG3' ' N ' ' A' ' 50' ' ' GLU . 47.7 ptt85 -57.66 -39.93 78.16 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 123.765 0.666 . . . . 0.0 111.829 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.487 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 6.2 tp10 -66.53 -49.38 66.69 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 123.566 0.746 . . . . 0.0 109.933 -178.568 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.585 ' HA ' HD11 ' A' ' 20' ' ' LEU . 22.3 mt -58.56 -57.21 13.95 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.666 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.464 ' HA ' HD12 ' A' ' 55' ' ' LEU . 22.0 t-20 -50.47 -53.74 27.43 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.697 1.599 . . . . 0.0 112.402 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -58.0 -49.39 77.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.248 0.619 . . . . 0.0 111.702 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.483 HG12 ' SD ' ' A' ' 58' ' ' MET . 70.3 t -63.91 -37.57 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.383 0.673 . . . . 0.0 110.675 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 52' ' ' ASN . 32.1 mt -54.08 -35.2 61.82 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.441 1.096 . . . . 0.0 112.751 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -69.93 -34.55 73.61 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.466 0.576 . . . . 0.0 111.782 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -66.7 -49.25 66.68 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.483 ' SD ' HG12 ' A' ' 54' ' ' VAL . 72.4 mtp -62.0 -36.01 80.23 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.263 1.025 . . . . 0.0 111.335 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -64.44 -39.58 94.09 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.943 0.897 . . . . 0.0 111.78 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -67.72 -25.94 65.91 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.316 0.646 . . . . 0.0 111.453 175.559 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -89.53 4.74 48.3 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.56 0.744 . . . . 0.0 110.616 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 62.18 13.61 5.98 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.136 1.375 . . . . 0.0 112.642 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.543 ' HB3' HD21 ' A' ' 25' ' ' LEU . 94.5 mttt -66.5 -39.45 88.71 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.352 1.061 . . . . 0.0 110.431 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.1 m -125.47 160.78 31.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-N 114.856 -1.065 . . . . 0.0 108.9 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.57 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 70.8 m -137.68 143.82 41.5 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.995 0.918 . . . . 0.0 108.705 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.6 101.0 12.54 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 t -92.94 -33.68 14.08 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.014 -171.646 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.679 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 18.5 m -139.07 162.71 50.76 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.079 0.952 . . . . 0.0 108.717 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.67 111.74 0.77 Allowed 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 122.941 2.428 . . . . 0.0 113.281 178.441 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 63.79 26.37 14.37 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.79 1.236 . . . . 0.0 111.538 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.679 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 87.5 m -130.2 125.6 35.33 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.769 0.828 . . . . 0.0 108.927 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -113.46 171.28 7.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.133 0.973 . . . . 0.0 109.449 -172.102 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.57 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 20.0 p -152.6 160.12 43.21 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.606 0.763 . . . . 0.0 109.008 177.868 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.602 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 26.1 tp -78.05 101.86 7.15 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -84.35 -39.62 8.98 Favored Glycine 0 C--N 1.341 0.806 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -93.04 58.5 2.42 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-N 114.811 -0.695 . . . . 0.0 111.472 177.131 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.2 t -75.86 88.57 2.87 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.029 0.932 . . . . 0.0 110.024 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 t70 51.5 73.51 0.96 Allowed Pre-proline 0 N--CA 1.48 1.04 0 C-N-CA 124.067 0.947 . . . . 0.0 110.59 -172.697 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -77.35 148.54 26.85 Favored 'Trans proline' 0 C--N 1.37 1.663 0 C-N-CA 122.455 2.103 . . . . 0.0 112.27 -175.012 . . . . . . . . 1 1 . 1 . 006 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 . . . . . 0 C--O 1.252 1.231 0 C-N-CA 123.468 0.707 . . . . 0.0 110.654 -179.128 . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 007 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 87.57 83.55 1.19 Allowed Glycine 0 C--N 1.35 1.348 0 CA-C-N 116.32 -0.4 . . . . 0.0 112.645 176.526 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -57.61 -37.64 73.59 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.671 0.788 . . . . 0.0 110.782 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -81.18 99.44 8.56 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.579 173.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -70.45 119.8 15.16 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.649 0.78 . . . . 0.0 109.928 -175.971 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -63.46 98.71 0.18 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.068 0.947 . . . . 0.0 110.732 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -141.17 106.23 4.98 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.3 m170 55.58 37.57 29.06 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.281 1.032 . . . . 0.0 110.172 -175.564 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.6 m -66.97 96.8 0.45 Allowed 'General case' 0 C--N 1.351 0.665 0 C-N-CA 124.195 0.998 . . . . 0.0 110.878 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.8 t-80 -161.43 140.83 10.21 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.2 mtm -77.32 116.26 17.77 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.82 97.19 0.21 Allowed 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.596 0.56 . . . . 0.0 110.258 -178.062 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -73.86 139.64 77.05 Favored Pre-proline 0 C--O 1.241 0.653 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.924 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.11 142.35 55.74 Favored 'Trans proline' 0 C--N 1.363 1.326 0 C-N-CA 122.048 1.832 . . . . 0.0 111.608 175.085 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -46.64 -78.02 0.09 OUTLIER Glycine 0 C--N 1.358 1.775 0 O-C-N 124.101 0.876 . . . . 0.0 115.132 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -57.29 -59.85 4.5 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 117.417 0.608 . . . . 0.0 111.784 176.924 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -65.01 -53.31 48.17 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.772 -0.633 . . . . 0.0 111.738 -166.16 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.69 -48.98 73.35 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-O 119.858 -0.412 . . . . 0.0 114.091 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -66.52 -47.34 73.23 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.989 0.515 . . . . 0.0 111.583 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.628 HD12 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -63.36 -40.54 97.55 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.721 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.1 tt0 -61.83 -48.36 80.9 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.572 1.149 . . . . 0.0 110.354 177.737 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -57.76 -41.08 81.2 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.484 0.713 . . . . 0.0 109.928 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.468 ' O ' HG23 ' A' ' 27' ' ' VAL . 20.2 mmm180 -68.28 -44.63 75.12 Favored 'General case' 0 C--N 1.352 0.695 0 C-N-CA 123.541 0.737 . . . . 0.0 112.398 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 53.9 mt -59.83 -50.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.137 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 21' ' ' GLU . 79.4 mt -63.92 -33.45 75.73 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.756 0.66 . . . . 0.0 110.744 -176.703 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -69.09 -43.72 73.93 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.469 0.708 . . . . 0.0 110.594 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 23' ' ' ARG . 72.8 t -62.66 -34.94 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.537 178.199 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 78.3 mt -66.62 -37.34 84.65 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.211 175.214 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -67.37 -52.72 36.65 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 124.193 0.997 . . . . 0.0 111.599 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -69.79 -31.46 69.4 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.102 0.561 . . . . 0.0 111.7 -171.094 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.94 -38.34 90.64 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.751 167.484 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.07 25.3 70.84 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.521 -175.711 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.6 p -161.17 159.75 24.33 Favored Pre-proline 0 C--O 1.245 0.859 0 C-N-CA 125.25 1.42 . . . . 0.0 109.105 -172.421 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.98 126.16 21.31 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.109 1.873 . . . . 0.0 112.773 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 89.3 t -104.03 138.38 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.126 0.97 . . . . 0.0 108.663 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -73.9 152.15 40.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.418 ' O ' HG23 ' A' ' 41' ' ' VAL . 26.2 tp -61.86 -46.51 89.11 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.859 0.863 . . . . 0.0 109.846 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.45 -45.05 3.06 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.902 1.281 . . . . 0.0 112.816 167.13 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.422 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 62.3 tt0 -79.79 -30.55 40.66 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.911 0.484 . . . . 0.0 111.034 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.97 -30.82 71.87 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.161 0.584 . . . . 0.0 110.997 178.269 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.5 ' HA ' HD11 ' A' ' 51' ' ' LEU . 64.4 t -55.75 -56.35 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.692 0.797 . . . . 0.0 112.024 176.887 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.422 ' HE2' ' HG3' ' A' ' 39' ' ' GLN . 63.2 pttt -68.85 -42.44 77.12 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 123.567 0.542 . . . . 0.0 111.668 -175.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -66.92 -49.39 65.68 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.516 0.727 . . . . 0.0 112.089 -177.505 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 56.9 m -81.35 -9.94 59.64 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 122.376 0.271 . . . . 0.0 110.805 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 60.13 29.49 19.05 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.481 1.112 . . . . 0.0 111.401 175.87 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.7 156.06 65.45 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 123.525 0.73 . . . . 0.0 111.003 -173.844 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.62 133.0 32.67 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.644 2.229 . . . . 0.0 111.938 174.275 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -46.97 -36.69 8.01 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.959 1.303 . . . . 0.0 113.072 174.91 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.0 mtm180 -54.6 -49.09 71.27 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.665 0.786 . . . . 0.0 110.957 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -67.15 -46.96 72.49 Favored 'General case' 0 C--O 1.25 1.126 0 C-N-CA 123.891 0.876 . . . . 0.0 110.659 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.507 HD23 HD11 ' A' ' 20' ' ' LEU . 95.9 mt -53.68 -51.74 62.25 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.997 0.919 . . . . 0.0 111.496 -176.811 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -53.47 -50.99 64.15 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 124.621 1.201 . . . . 0.0 112.444 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -57.07 -39.88 75.81 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.993 0.808 . . . . 0.0 111.269 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.628 HG21 HD12 ' A' ' 20' ' ' LEU . 98.2 t -71.49 -43.79 71.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.567 0.747 . . . . 0.0 110.993 176.098 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.455 HD13 ' NE1' ' A' ' 72' ' ' TRP . 79.6 mt -54.04 -45.05 71.53 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.474 1.109 . . . . 0.0 113.368 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.78 -25.4 59.04 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.112 0.414 . . . . 0.0 111.534 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -68.37 -53.52 23.4 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.721 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 68.7 mtm -60.79 -31.86 71.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.995 0.918 . . . . 0.0 110.987 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -62.62 -46.81 86.55 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.828 0.851 . . . . 0.0 110.861 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.415 ' NZ ' ' HB2' ' A' ' 60' ' ' LYS . 4.9 ttmp? -68.18 -26.11 65.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.443 0.697 . . . . 0.0 111.418 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -90.4 -0.0 57.46 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.314 0.646 . . . . 0.0 111.516 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 67.75 10.99 8.16 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 124.928 1.291 . . . . 0.0 112.845 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.532 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.1 mttt -69.51 -28.24 65.88 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.656 0.783 . . . . 0.0 111.04 174.285 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.0 161.23 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.544 0.738 . . . . 0.0 110.048 171.822 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.7 m -139.08 152.21 47.34 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.75 0.82 . . . . 0.0 108.876 172.814 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.7 tp -101.25 106.96 18.22 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.2 p -92.97 -39.79 10.92 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.636 0.775 . . . . 0.0 111.178 -175.063 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.509 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 25.3 m -140.68 167.04 18.97 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 123.854 0.861 . . . . 0.0 109.249 -173.879 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.71 112.43 0.69 Allowed 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 123.124 2.549 . . . . 0.0 113.429 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 62.63 18.96 10.98 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.372 1.069 . . . . 0.0 112.856 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.509 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 31.4 m -119.78 123.17 43.07 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 123.574 0.75 . . . . 0.0 110.0 -174.506 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.455 ' NE1' HD13 ' A' ' 55' ' ' LEU . 62.5 m95 -119.32 151.63 38.12 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.339 1.055 . . . . 0.0 109.614 -169.841 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 24.4 p -128.22 157.03 41.98 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 109.337 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.428 HD23 ' OG1' ' A' ' 77' ' ' THR . 46.3 tp -77.61 131.19 37.68 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.937 0.495 . . . . 0.0 110.839 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.3 77.92 0.85 Allowed Glycine 0 C--N 1.349 1.281 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 171.69 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.79 -23.67 0.82 Allowed Glycine 0 C--N 1.337 0.602 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -170.342 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.428 ' OG1' HD23 ' A' ' 74' ' ' LEU . 12.6 m -129.4 56.01 1.73 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 173.321 . . . . . . . . 2 2 . 1 . 007 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.35 151.33 92.02 Favored Pre-proline 0 N--CA 1.485 1.295 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.111 -177.139 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -58.71 117.08 3.74 Favored 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 122.93 2.42 . . . . 0.0 113.495 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 . . . . . 0 C--O 1.254 1.293 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.429 . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 N--CA 1.485 1.311 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 . . . . . . . . . 0 0 . 1 . 008 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -177.42 101.12 0.15 Allowed Glycine 0 C--N 1.347 1.145 0 C-N-CA 121.423 -0.418 . . . . 0.0 113.303 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -115.85 153.85 30.75 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.433 0.693 . . . . 0.0 109.525 173.414 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -71.35 106.96 4.07 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.859 0.864 . . . . 0.0 109.467 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -89.51 -58.15 2.63 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 123.591 0.557 . . . . 0.0 110.423 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -119.44 124.4 46.43 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.804 0.842 . . . . 0.0 110.477 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -67.98 140.59 56.4 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.411 1.084 . . . . 0.0 109.834 174.581 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -57.38 97.21 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.486 0.715 . . . . 0.0 110.595 178.622 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.0 t -164.05 119.29 1.55 Allowed 'General case' 0 C--O 1.235 0.297 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.9 t-80 -62.26 98.27 0.11 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.356 0.662 . . . . 0.0 110.91 -173.358 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.7 mtt 60.75 -83.76 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.809 0 O-C-N 124.87 1.356 . . . . 0.0 110.521 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.14 19.98 5.24 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.594 1.157 . . . . 0.0 113.077 174.973 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -137.67 71.84 50.39 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 124.077 0.951 . . . . 0.0 108.58 -172.126 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -90.15 -2.55 5.43 Favored 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.35 2.7 . . . . 0.0 114.331 -174.087 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -47.15 -83.71 0.02 OUTLIER Glycine 0 C--N 1.352 1.43 0 N-CA-C 115.306 0.882 . . . . 0.0 115.306 177.809 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.8 mtm105 -54.86 -45.38 74.56 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.893 0.877 . . . . 0.0 111.456 -176.259 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -67.7 -46.04 73.39 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 124.645 1.215 . . . . 0.0 112.103 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.32 -38.86 96.94 Favored Glycine 0 C--N 1.342 0.878 0 O-C-N 123.392 0.433 . . . . 0.0 113.012 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.5 m-70 -73.43 -36.21 65.9 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.191 0.52 . . . . 0.0 110.52 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.523 HD12 HG21 ' A' ' 54' ' ' VAL . 2.0 tm? -65.82 -42.53 90.49 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.304 1.042 . . . . 0.0 110.148 174.631 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -61.35 -42.8 99.28 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.787 0.835 . . . . 0.0 109.898 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -42.54 93.92 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.948 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.438 ' O ' HG23 ' A' ' 27' ' ' VAL . 12.7 tpt180 -67.16 -42.27 84.59 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.137 -177.791 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 78.5 mt -57.01 -49.61 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 O-C-N 123.909 0.756 . . . . 0.0 109.876 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 63' ' ' LYS . 92.0 mt -59.24 -39.59 83.25 Favored 'General case' 0 C--N 1.349 0.547 0 O-C-N 123.987 0.804 . . . . 0.0 111.142 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.9 tt0 -66.62 -45.44 79.1 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.667 0.605 . . . . 0.0 110.911 -176.777 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 23' ' ' ARG . 86.6 t -56.34 -42.83 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.289 0.636 . . . . 0.0 110.279 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 97.8 mt -71.9 -34.59 69.25 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.635 -177.906 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.45 ' HA ' HD22 ' A' ' 74' ' ' LEU . 27.3 m -70.63 -45.65 64.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.314 0.646 . . . . 0.0 111.68 179.518 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.1 -33.17 74.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.913 0.485 . . . . 0.0 110.867 -177.239 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.68 -44.88 66.11 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.705 0.628 . . . . 0.0 110.345 172.024 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.42 25.52 67.0 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.782 -170.245 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.7 m -148.41 155.29 42.46 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 124.082 0.953 . . . . 0.0 110.314 -166.999 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -60.53 109.21 0.61 Allowed 'Trans proline' 0 C--N 1.368 1.564 0 C-N-CA 123.063 2.509 . . . . 0.0 112.089 169.567 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.5 t -97.12 130.65 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.991 0.916 . . . . 0.0 108.531 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.64 153.29 43.64 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 41' ' ' VAL . 36.1 tp -59.18 -45.46 90.99 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.991 0.807 . . . . 0.0 110.23 -178.276 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.58 -47.27 10.29 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.362 1.065 . . . . 0.0 112.94 170.213 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.436 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.9 tt0 -77.32 -34.89 55.27 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.002 0.521 . . . . 0.0 110.397 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.8 mt -56.76 -41.51 77.72 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.618 0.767 . . . . 0.0 110.591 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 37' ' ' LEU . 92.1 t -53.59 -56.34 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 124.243 0.965 . . . . 0.0 111.635 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -74.59 -35.18 62.99 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.27 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 13.7 mm-40 -69.98 -45.86 66.44 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 122.713 0.405 . . . . 0.0 112.088 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.589 ' SG ' ' HB3' ' A' ' 46' ' ' ALA . 23.8 p -72.6 -19.66 61.43 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.399 0.279 . . . . 0.0 111.042 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 64.8 37.84 7.1 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 124.292 1.037 . . . . 0.0 110.106 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.589 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -134.64 159.45 72.16 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.679 -173.213 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.71 134.81 22.68 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.426 2.084 . . . . 0.0 111.95 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -50.21 -31.84 14.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.669 1.188 . . . . 0.0 113.086 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -61.03 -48.64 80.84 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 122.622 0.369 . . . . 0.0 111.183 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -65.86 -46.61 77.8 Favored 'General case' 0 C--O 1.242 0.691 0 O-C-N 123.772 0.67 . . . . 0.0 110.55 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.569 HD21 ' SG ' ' A' ' 44' ' ' CYS . 93.8 mt -55.06 -58.61 6.95 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 124.267 0.98 . . . . 0.0 110.746 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -48.13 -53.24 17.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.658 1.583 . . . . 0.0 112.216 -174.497 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 94.7 mt-30 -56.52 -48.83 76.4 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 123.945 0.778 . . . . 0.0 112.423 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.585 HG12 ' SD ' ' A' ' 58' ' ' MET . 70.1 t -63.63 -43.73 98.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 123.734 0.647 . . . . 0.0 110.726 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 77.0 mt -50.7 -43.9 57.9 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.237 1.415 . . . . 0.0 113.739 -177.335 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.459 ' O ' ' HG3' ' A' ' 60' ' ' LYS . 92.5 m-85 -73.1 -30.92 64.0 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.508 0.595 . . . . 0.0 112.21 -178.985 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.4 ttt85 -74.02 -51.99 14.13 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.443 0.297 . . . . 0.0 110.209 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.585 ' SD ' HG12 ' A' ' 54' ' ' VAL . 19.7 ptm -65.82 -19.26 65.82 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.137 0.575 . . . . 0.0 110.812 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -65.46 -44.31 87.6 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.555 0.742 . . . . 0.0 110.759 171.49 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 56' ' ' TYR . 61.3 mttm -66.35 -31.68 72.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.637 0.775 . . . . 0.0 110.826 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -84.45 6.24 24.19 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.227 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.81 10.93 7.24 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.872 1.269 . . . . 0.0 112.305 176.441 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.602 ' HB3' HD21 ' A' ' 25' ' ' LEU . 92.3 mttt -70.85 -34.97 72.19 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.586 0.754 . . . . 0.0 110.505 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.509 HG22 ' HG3' ' A' ' 58' ' ' MET . 16.4 m -133.64 160.33 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.289 0.635 . . . . 0.0 109.731 174.409 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.1 m -125.45 150.6 47.17 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.5 tp -104.49 104.67 14.56 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.1 p -87.73 -42.75 12.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.73 0.812 . . . . 0.0 110.896 -172.654 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.502 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 30.7 m -139.84 170.63 9.41 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.035 0.934 . . . . 0.0 109.486 -174.476 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.32 106.49 0.08 OUTLIER 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 123.418 2.746 . . . . 0.0 114.071 173.714 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.04 20.0 10.46 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.765 1.226 . . . . 0.0 112.626 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.502 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 34.6 m -114.64 118.47 33.76 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.61 0.764 . . . . 0.0 109.153 -174.84 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 58.3 m95 -116.92 139.15 50.98 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.948 0.899 . . . . 0.0 109.314 -169.572 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 45.8 t -117.38 165.08 13.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.029 0.532 . . . . 0.0 109.902 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 29' ' ' THR . 45.5 tp -65.93 111.64 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 122.969 0.508 . . . . 0.0 110.112 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.6 -40.67 12.25 Favored Glycine 0 N--CA 1.465 0.57 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 175.303 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -89.91 83.75 1.37 Allowed Glycine 0 C--N 1.343 0.926 0 CA-C-O 119.721 -0.488 . . . . 0.0 111.963 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 32.5 m -56.89 100.79 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.698 0.799 . . . . 0.0 111.42 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -62.18 129.24 91.99 Favored Pre-proline 0 N--CA 1.472 0.674 0 C-N-CA 123.311 0.645 . . . . 0.0 110.857 177.8 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -78.43 44.46 1.63 Allowed 'Trans proline' 0 C--N 1.368 1.6 0 C-N-CA 123.036 2.49 . . . . 0.0 112.759 177.119 . . . . . . . . 1 1 . 1 . 008 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 . . . . . 0 CA--C 1.557 1.242 0 C-N-CA 124.35 1.06 . . . . 0.0 109.559 -177.734 . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.487 1.378 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 009 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.87 32.14 7.87 Favored Glycine 0 C--N 1.347 1.175 0 O-C-N 123.315 0.385 . . . . 0.0 113.141 178.523 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -82.13 -32.03 30.31 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.215 0.606 . . . . 0.0 111.476 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 44.2 m80 69.17 20.83 7.45 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.956 1.302 . . . . 0.0 111.36 -174.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -97.85 87.23 3.95 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.509 0.723 . . . . 0.0 109.406 -177.9 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -113.68 105.62 13.52 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.787 0.835 . . . . 0.0 109.872 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 27.3 t-80 -157.07 140.96 16.14 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 176.289 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -58.16 -33.62 69.4 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -174.037 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.9 p -74.96 77.76 2.18 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 122.956 0.502 . . . . 0.0 111.306 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.3 p80 -73.19 75.62 1.29 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.752 0.821 . . . . 0.0 109.196 176.463 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.6 ttm 66.38 -70.92 0.1 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.919 1.287 . . . . 0.0 108.572 -160.906 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -169.28 152.75 5.05 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.433 1.093 . . . . 0.0 109.661 174.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -72.78 143.5 84.62 Favored Pre-proline 0 N--CA 1.478 0.929 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 165.508 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -64.67 80.45 0.18 Allowed 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 123.074 2.516 . . . . 0.0 113.019 -175.773 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -28.65 95.46 0.01 OUTLIER Glycine 0 C--N 1.357 1.731 0 C-N-CA 125.566 1.555 . . . . 0.0 114.813 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 -52.97 -12.04 0.29 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -170.71 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -51.95 -52.66 48.77 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.186 0.994 . . . . 0.0 112.769 -163.806 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.4 99.75 Favored Glycine 0 C--N 1.351 1.378 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -69.21 -45.65 69.36 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -177.231 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.564 HD11 HD23 ' A' ' 51' ' ' LEU . 2.6 tm? -64.69 -37.26 86.98 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.125 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -60.91 -50.85 71.76 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.235 1.014 . . . . 0.0 110.461 175.792 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -62.62 -31.87 72.79 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 124.617 1.198 . . . . 0.0 110.559 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -71.35 -44.11 65.68 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.11 0.564 . . . . 0.0 111.311 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.427 HD12 ' HE3' ' A' ' 58' ' ' MET . 79.5 mt -60.53 -47.41 92.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 177.094 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.67 -36.05 73.54 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.678 0.791 . . . . 0.0 110.66 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -65.45 -48.71 71.78 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.034 0.834 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 71.4 t -58.56 -39.42 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.883 0.873 . . . . 0.0 110.752 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -68.46 -38.89 81.5 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.098 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 67.5 m -72.18 -45.69 59.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.526 0.73 . . . . 0.0 111.991 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.16 -38.76 91.58 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.042 0.537 . . . . 0.0 110.969 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.83 83.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.414 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 67.2 22.53 72.72 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.322 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.1 p -151.39 166.73 14.49 Favored Pre-proline 0 C--O 1.246 0.901 0 C-N-CA 123.999 0.92 . . . . 0.0 109.697 -169.76 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.18 118.51 5.41 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.424 2.083 . . . . 0.0 111.918 171.345 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 99.1 t -102.5 125.29 56.8 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 67.2 mttm -69.52 155.08 41.04 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.981 0.512 . . . . 0.0 110.523 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 41' ' ' VAL . 33.4 tp -61.19 -49.75 75.92 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.419 0.688 . . . . 0.0 110.726 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.83 -38.37 15.81 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.841 0.857 . . . . 0.0 112.578 171.439 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.465 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 62.5 tt0 -75.36 -38.88 59.81 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 122.795 0.438 . . . . 0.0 110.574 176.785 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.8 mt -56.98 -40.59 76.81 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.422 0.689 . . . . 0.0 110.641 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 37' ' ' LEU . 51.7 t -55.22 -54.07 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 123.962 0.789 . . . . 0.0 111.639 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -69.53 -39.01 77.75 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.241 0.338 . . . . 0.0 111.375 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 46.6 mm-40 -64.35 -53.67 45.06 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.631 ' SG ' HD21 ' A' ' 51' ' ' LEU . 31.6 p -76.92 -24.45 52.44 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 122.721 0.408 . . . . 0.0 111.132 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 63.3 36.61 11.6 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.107 0.963 . . . . 0.0 110.919 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.429 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -118.81 150.47 48.51 Favored Pre-proline 0 C--O 1.242 0.697 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.394 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.08 135.84 45.5 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.207 1.938 . . . . 0.0 111.437 177.52 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -50.02 -33.28 17.58 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.683 1.193 . . . . 0.0 112.64 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -61.54 -45.06 95.77 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.581 0.752 . . . . 0.0 111.74 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -65.0 -50.16 67.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.618 0.767 . . . . 0.0 110.387 174.173 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.631 HD21 ' SG ' ' A' ' 44' ' ' CYS . 97.0 mt -53.95 -58.89 5.63 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 124.201 1.0 . . . . 0.0 112.01 -176.896 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.453 ' HA ' HD12 ' A' ' 55' ' ' LEU . 5.3 m-20 -55.7 -46.43 77.68 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.554 1.159 . . . . 0.0 111.953 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -54.08 -48.82 70.25 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 123.853 0.721 . . . . 0.0 110.691 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.486 HG21 HD12 ' A' ' 20' ' ' LEU . 56.9 t -70.15 -36.08 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.101 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' A' ' 52' ' ' ASN . 57.7 mt -53.55 -42.92 68.01 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.437 1.095 . . . . 0.0 113.649 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -72.62 -27.17 61.99 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 118.681 0.673 . . . . 0.0 111.405 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -67.35 -58.58 4.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.662 0.785 . . . . 0.0 110.473 176.01 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.545 ' SD ' HG11 ' A' ' 64' ' ' VAL . 14.4 ptp -61.56 -28.73 69.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.724 0.81 . . . . 0.0 111.561 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -65.89 -43.71 87.46 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 0.0 110.963 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.425 ' NZ ' ' HB2' ' A' ' 60' ' ' LYS . 5.0 ttmp? -63.35 -39.24 94.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.716 0.806 . . . . 0.0 111.008 174.638 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -82.78 4.15 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.231 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.6 mt 63.03 15.04 8.11 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.365 1.466 . . . . 0.0 112.553 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.72 -23.15 60.81 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 124.411 1.084 . . . . 0.0 110.433 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.545 HG11 ' SD ' ' A' ' 58' ' ' MET . 13.3 m -130.52 170.09 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.115 0.566 . . . . 0.0 109.933 171.386 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.8 t -135.0 153.37 52.11 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.345 173.277 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.0 tp -101.25 101.82 12.58 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 176.148 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.4 p -81.52 -41.68 21.34 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.965 0.506 . . . . 0.0 110.444 -176.165 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.544 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 42.3 t -140.21 152.3 66.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.644 0.778 . . . . 0.0 108.915 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.16 124.37 8.9 Favored 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.135 2.557 . . . . 0.0 112.431 168.378 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 69.31 9.53 7.36 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.155 1.382 . . . . 0.0 112.715 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.544 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 58.3 m -129.02 120.04 25.32 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.64 0.776 . . . . 0.0 109.264 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -107.15 166.81 10.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.732 0.813 . . . . 0.0 108.867 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.3 t -152.82 165.13 36.35 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 77' ' ' THR . 22.3 tp -71.12 148.39 47.47 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 176.711 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.27 85.77 0.24 Allowed Glycine 0 C--N 1.347 1.14 0 O-C-N 123.497 0.498 . . . . 0.0 112.256 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 110.21 -7.77 30.84 Favored Glycine 0 N--CA 1.461 0.316 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.452 ' O ' HD23 ' A' ' 74' ' ' LEU . 31.4 m 68.25 -55.45 0.51 Allowed 'General case' 0 C--N 1.36 1.022 0 C-N-CA 125.947 1.699 . . . . 0.0 110.878 -171.069 . . . . . . . . 2 2 . 1 . 009 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -121.26 96.46 48.09 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 166.666 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -58.16 157.08 26.77 Favored 'Trans proline' 0 C--N 1.374 1.91 0 C-N-CA 123.519 2.813 . . . . 0.0 114.562 -174.956 . . . . . . . . 1 1 . 1 . 009 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 . . . . . 0 C--O 1.251 1.155 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.374 . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.1 mtm . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 120.193 0.044 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 010 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.72 118.3 0.85 Allowed Glycine 0 C--N 1.342 0.907 0 N-CA-C 112.03 -0.428 . . . . 0.0 112.03 178.087 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 42.3 m-70 -131.61 -169.48 2.2 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.778 1.231 . . . . 0.0 108.414 171.01 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 58.12 69.91 0.69 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.069 0.948 . . . . 0.0 109.671 -174.446 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -53.89 144.14 19.51 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.306 0.642 . . . . 0.0 111.348 -177.153 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 24.1 m170 -68.46 125.91 27.96 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.373 0.669 . . . . 0.0 110.898 -173.489 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 t60 72.04 22.11 3.83 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 125.333 1.453 . . . . 0.0 111.345 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.2 t60 -70.95 99.88 1.86 Allowed 'General case' 0 C--N 1.357 0.934 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.045 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 m -94.44 147.05 23.63 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.691 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.8 m80 -111.7 20.6 16.94 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.779 0.831 . . . . 0.0 109.916 170.83 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.4 mmt 61.21 21.37 11.83 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.453 1.101 . . . . 0.0 110.763 -171.173 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.82 99.92 11.48 Favored 'General case' 0 C--N 1.346 0.425 0 C-N-CA 124.548 1.139 . . . . 0.0 108.2 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -108.16 99.81 33.53 Favored Pre-proline 0 C--O 1.241 0.621 0 C-N-CA 122.698 0.399 . . . . 0.0 110.397 -173.236 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -88.86 59.6 2.47 Favored 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.921 2.414 . . . . 0.0 109.074 168.232 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -45.97 -83.56 0.02 OUTLIER Glycine 0 C--N 1.355 1.638 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 -168.094 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.6 ttt-85 -56.91 -49.79 74.52 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.473 1.109 . . . . 0.0 112.598 -173.776 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.76 -48.71 79.46 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.483 0.713 . . . . 0.0 111.905 -177.412 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.41 74.26 Favored Glycine 0 C--N 1.345 1.058 0 O-C-N 123.971 0.794 . . . . 0.0 114.709 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -75.99 -38.68 57.12 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.186 0.594 . . . . 0.0 109.78 177.049 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.599 HD12 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -64.54 -43.64 93.34 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.712 176.529 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -65.55 -40.39 92.79 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.272 1.029 . . . . 0.0 110.043 176.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.0 -38.09 87.3 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.738 0.815 . . . . 0.0 110.223 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 27' ' ' VAL . 22.8 mmm180 -63.76 -50.83 67.5 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 122.737 0.415 . . . . 0.0 110.919 174.865 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.43 HG21 HD21 ' A' ' 55' ' ' LEU . 87.8 mt -56.1 -54.23 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 O-C-N 123.863 0.727 . . . . 0.0 110.354 -175.641 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 63' ' ' LYS . 90.0 mt -65.01 -35.43 81.17 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.953 0.901 . . . . 0.0 111.486 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -66.09 -47.4 74.33 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.296 0.638 . . . . 0.0 110.328 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 23' ' ' ARG . 61.1 t -59.81 -40.9 83.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 124.516 1.126 . . . . 0.0 111.205 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.57 -38.65 87.52 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.742 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 73.5 m -68.73 -50.46 50.53 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.121 0.968 . . . . 0.0 111.776 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -67.44 -40.46 85.44 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.97 0.508 . . . . 0.0 110.994 -173.813 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -42.19 98.8 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.386 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.76 29.4 64.4 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 115.164 -0.926 . . . . 0.0 112.249 -174.779 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.2 m -150.94 153.89 33.71 Favored Pre-proline 0 C--O 1.242 0.665 0 C-N-CA 125.296 1.438 . . . . 0.0 107.897 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -60.98 114.05 2.0 Allowed 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.194 1.929 . . . . 0.0 111.382 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.7 t -96.23 128.21 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.357 1.063 . . . . 0.0 108.281 -176.284 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 49.0 mtmt -58.58 154.72 13.68 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.447 0.699 . . . . 0.0 111.397 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.5 tp -67.43 -50.74 58.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.017 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -53.67 -28.1 31.42 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -81.88 -30.64 31.87 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.909 0.484 . . . . 0.0 109.882 177.121 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.36 -26.38 67.24 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.138 0.575 . . . . 0.0 110.087 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.448 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.5 t -58.52 -53.23 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.498 0.719 . . . . 0.0 111.4 174.63 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -70.79 -40.72 72.38 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.887 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -69.46 -51.77 32.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.972 0.509 . . . . 0.0 112.128 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 57.2 m -78.03 -13.22 59.95 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.385 0.274 . . . . 0.0 110.789 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 60.38 31.39 20.36 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.008 1.323 . . . . 0.0 111.891 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.24 154.43 56.13 Favored Pre-proline 0 N--CA 1.473 0.681 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.501 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.444 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 11.4 Cg_endo -56.12 136.72 76.56 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.81 2.34 . . . . 0.0 111.632 169.999 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.414 ' HA ' HD12 ' A' ' 51' ' ' LEU . 26.0 ttpp -48.96 -41.5 34.32 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.196 0.998 . . . . 0.0 112.225 172.858 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.444 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 21.8 ptt180 -59.0 -37.62 77.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.826 0.45 . . . . 0.0 111.924 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.41 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 23.8 tp10 -66.79 -50.15 63.58 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 123.727 0.811 . . . . 0.0 110.029 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.464 HD23 HD11 ' A' ' 20' ' ' LEU . 76.7 mt -57.22 -50.08 74.0 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.157 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -52.07 -51.54 56.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.465 1.103 . . . . 0.0 111.504 -176.938 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -66.86 -37.06 83.73 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 124.127 0.892 . . . . 0.0 111.524 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.704 HG12 ' SD ' ' A' ' 58' ' ' MET . 95.7 t -66.38 -47.52 83.76 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 24' ' ' ILE . 39.3 mt -57.72 -37.77 74.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.223 1.409 . . . . 0.0 112.888 177.997 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -68.54 -28.64 67.16 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 122.903 0.481 . . . . 0.0 111.413 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -71.54 -53.55 13.44 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 171.358 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.704 ' SD ' HG12 ' A' ' 54' ' ' VAL . 77.9 mtp -61.01 -32.38 71.98 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.971 1.308 . . . . 0.0 113.051 -172.83 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -70.44 -34.16 72.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.366 0.266 . . . . 0.0 111.162 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -71.54 -24.56 61.97 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.377 0.671 . . . . 0.0 110.326 173.085 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.07 5.8 42.79 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.368 1.067 . . . . 0.0 110.718 174.261 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 60.7 14.93 5.39 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.341 1.456 . . . . 0.0 112.775 177.384 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.537 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.3 mttt -73.97 -40.9 62.68 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.214 1.006 . . . . 0.0 110.838 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.1 m -126.45 158.35 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.492 0.717 . . . . 0.0 110.517 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.1 m -135.63 150.27 49.58 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.627 1.171 . . . . 0.0 108.323 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.1 tp -99.96 110.77 23.09 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.5 p -82.54 -46.39 13.44 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 -177.43 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.424 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.4 m -133.21 163.65 49.59 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.311 -1.328 . . . . 0.0 108.18 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 19.3 Cg_exo -25.52 -63.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.393 2.901 1 C-N-CA 125.464 4.109 . . . . 0.0 116.432 -174.913 . . . . . . . . 3 3 . 1 . 010 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.58 53.59 1.74 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.613 0.765 . . . . 0.0 110.508 172.904 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 36.0 m -132.39 120.53 22.15 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 172.379 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -106.21 169.17 8.66 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.449 1.1 . . . . 0.0 109.273 -174.666 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.2 t -151.16 159.96 44.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.656 0.782 . . . . 0.0 109.633 -175.726 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.642 HD21 ' HB2' ' A' ' 78' ' ' ASP . 35.7 tp -72.89 104.3 4.0 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 174.634 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -75.41 -25.84 67.19 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.64 177.623 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -76.12 161.79 52.21 Favored Glycine 0 C--N 1.349 1.27 0 O-C-N 123.94 0.435 . . . . 0.0 112.911 176.133 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.8 t -95.68 34.15 1.54 Allowed 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.594 0.758 . . . . 0.0 109.803 178.015 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 78' ' ' ASP . . . . . 0.642 ' HB2' HD21 ' A' ' 74' ' ' LEU . 11.7 m-20 -63.28 119.92 57.28 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 123.88 0.872 . . . . 0.0 111.939 -174.511 . . . . . . . . 2 2 . 1 . 010 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -83.47 -162.95 0.18 Allowed 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 123.367 2.711 . . . . 0.0 111.629 174.649 . . . . . . . . 1 1 . 1 . 010 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 . . . . . 0 CA--C 1.555 1.16 0 C-N-CA 123.573 0.749 . . . . 0.0 109.626 175.143 . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 0 0 . 1 . 011 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 165.16 160.3 12.39 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 84.6 t60 59.21 88.93 0.06 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.715 1.206 . . . . 0.0 110.342 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -104.77 165.5 11.02 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.392 0.677 . . . . 0.0 109.47 -177.696 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.7 p80 -125.32 39.45 3.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.302 0.641 . . . . 0.0 110.67 -177.927 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.1 p80 -63.25 -18.41 63.52 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 122.702 0.401 . . . . 0.0 111.976 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -62.42 139.58 58.56 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.452 0.701 . . . . 0.0 110.341 169.387 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -71.76 -39.96 69.65 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.189 0.996 . . . . 0.0 111.604 -174.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.7 p -77.73 138.89 39.28 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.446 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 12.8 t60 -73.47 89.1 1.64 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 11' ' ' MET . . . . . 0.498 ' SD ' ' N ' ' A' ' 12' ' ' ALA . 1.2 tmt? -76.09 159.6 30.59 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 169.045 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 12' ' ' ALA . . . . . 0.498 ' N ' ' SD ' ' A' ' 11' ' ' MET . . . 68.6 177.44 0.26 Allowed 'General case' 0 C--O 1.249 1.029 0 C-N-CA 123.961 0.904 . . . . 0.0 110.285 -174.374 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 51.78 69.67 2.36 Favored Pre-proline 0 N--CA 1.477 0.922 0 C-N-CA 123.601 0.76 . . . . 0.0 109.278 -166.432 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -71.86 -172.71 0.87 Allowed 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 122.533 2.155 . . . . 0.0 112.59 -169.716 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -79.29 -179.5 52.11 Favored Glycine 0 C--O 1.252 1.252 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 168.171 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.436 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 38.5 ptt180 -58.61 -38.39 77.9 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 116.925 0.362 . . . . 0.0 111.842 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -64.4 -50.73 66.47 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 123.751 0.821 . . . . 0.0 110.237 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -54.42 -41.0 70.89 Favored Glycine 0 C--N 1.351 1.403 0 O-C-N 123.81 0.694 . . . . 0.0 114.37 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -75.76 -40.02 56.07 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.445 0.298 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.484 HD11 HD23 ' A' ' 51' ' ' LEU . 1.5 tm? -60.0 -52.8 63.86 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.817 1.247 . . . . 0.0 110.098 -178.911 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.759 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.8 tt0 -62.19 -44.66 96.1 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.995 1.318 . . . . 0.0 110.513 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -56.91 -44.98 82.93 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.37 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.438 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 0.8 OUTLIER -66.27 -47.7 72.82 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.312 0.645 . . . . 0.0 112.33 -178.793 . . . . . . . . 3 3 . 1 . 011 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.8 mt -60.74 -50.99 78.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 123.589 0.556 . . . . 0.0 110.126 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -64.2 -38.36 90.77 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 111.806 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -71.47 -40.12 70.49 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.747 0.654 . . . . 0.0 110.456 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.4 t -61.89 -39.16 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.144 0.578 . . . . 0.0 110.032 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.42 -29.03 63.34 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.564 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 29' ' ' THR . . . . . 0.481 ' HA ' HD22 ' A' ' 74' ' ' LEU . 86.4 m -75.49 -44.15 45.42 Favored 'General case' 0 C--N 1.353 0.755 0 C-N-CA 123.584 0.754 . . . . 0.0 111.395 176.79 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -70.11 -37.25 75.3 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.498 0.719 . . . . 0.0 110.229 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.33 -39.82 71.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 122.959 0.504 . . . . 0.0 109.7 172.711 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.53 31.5 67.01 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.751 -175.633 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -160.45 149.47 13.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.946 0.899 . . . . 0.0 109.091 -166.671 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -60.77 113.4 1.69 Allowed 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.976 2.451 . . . . 0.0 112.712 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.3 t -102.61 138.61 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.662 1.185 . . . . 0.0 108.208 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.87 149.48 50.53 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.347 0.659 . . . . 0.0 110.588 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 41' ' ' VAL . 25.3 tp -59.37 -49.08 79.19 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.555 1.159 . . . . 0.0 110.953 178.573 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.75 -36.98 17.63 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.107 0.963 . . . . 0.0 113.117 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.524 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 51.2 tt0 -76.66 -34.48 58.25 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.766 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.45 -29.24 69.89 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.288 0.635 . . . . 0.0 110.497 177.417 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.495 ' HA ' HD11 ' A' ' 51' ' ' LEU . 93.9 t -59.8 -53.09 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.839 0.855 . . . . 0.0 111.155 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HE2' ' HG3' ' A' ' 39' ' ' GLN . 63.5 pttt -73.41 -34.73 65.64 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 123.648 0.592 . . . . 0.0 111.487 -177.767 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 26.9 mm-40 -62.04 -55.86 24.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.63 0.372 . . . . 0.0 110.616 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 45.4 t -81.83 -10.82 59.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.674 0.39 . . . . 0.0 110.714 -174.309 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 56.32 32.62 20.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.787 1.235 . . . . 0.0 110.886 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.61 149.72 53.48 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.176 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -61.11 130.93 34.37 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.599 2.199 . . . . 0.0 111.609 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -44.53 -36.29 2.91 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.387 1.475 . . . . 0.0 112.924 172.618 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.264 1.025 . . . . 0.0 111.544 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.08 -39.52 75.56 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.229 0.612 . . . . 0.0 111.061 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 41' ' ' VAL . 93.9 mt -56.66 -52.46 64.82 Favored 'General case' 0 C--N 1.359 1.005 0 O-C-N 123.938 0.774 . . . . 0.0 110.67 175.358 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.8 m-20 -50.54 -51.39 48.27 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 125.137 1.375 . . . . 0.0 111.886 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 54.9 tt0 -50.89 -52.83 37.94 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.336 1.054 . . . . 0.0 112.032 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.39 -37.86 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.471 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.414 HD13 ' NE1' ' A' ' 72' ' ' TRP . 38.8 mt -57.39 -46.02 83.88 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.863 1.265 . . . . 0.0 114.115 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -71.08 -28.76 64.57 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 119.271 0.941 . . . . 0.0 110.908 -178.821 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.43 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.5 tpp85 -66.73 -50.21 63.51 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.164 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.759 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 76.0 mtm -66.68 -27.53 67.73 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 124.109 0.963 . . . . 0.0 112.138 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -67.11 -40.37 86.87 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.583 0.753 . . . . 0.0 109.891 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -71.44 -34.54 70.37 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.873 0.733 . . . . 0.0 110.747 173.263 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 57' ' ' ARG . 51.0 mt-10 -76.69 -5.17 46.87 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.154 0.582 . . . . 0.0 111.197 174.966 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.8 mt 66.04 14.03 9.4 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.783 1.633 . . . . 0.0 112.492 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.541 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.2 mttt -69.65 -35.31 75.06 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 124.374 1.07 . . . . 0.0 110.611 175.218 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.2 m -126.69 152.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 O-C-N 123.907 0.754 . . . . 0.0 109.479 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 45.1 t -119.86 147.39 44.75 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.14 0.976 . . . . 0.0 108.826 176.093 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.6 tp -99.38 101.67 13.02 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.1 p -87.69 -34.15 18.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.677 0.791 . . . . 0.0 111.456 -175.097 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.436 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.7 m -139.42 161.16 58.62 Favored Pre-proline 0 N--CA 1.482 1.142 0 CA-C-O 117.21 -1.376 . . . . 0.0 107.57 176.301 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -25.53 -59.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 125.261 3.974 . . . . 0.0 116.606 -176.175 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -128.83 53.4 1.86 Allowed 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.456 0.646 . . . . 0.0 110.586 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.436 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 70.1 m -130.97 127.88 39.29 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.758 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.414 ' NE1' HD13 ' A' ' 55' ' ' LEU . 81.6 m95 -118.38 137.55 53.04 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.421 0.688 . . . . 0.0 110.468 -171.487 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 49.9 t -116.19 164.3 14.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.949 0.899 . . . . 0.0 109.518 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 29' ' ' THR . 40.9 tp -67.64 108.56 2.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 173.962 . . . . . . . . 2 2 . 1 . 011 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.04 -25.47 72.11 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.782 0.676 . . . . 0.0 112.533 176.713 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.35 57.37 5.06 Favored Glycine 0 C--N 1.356 1.674 0 N-CA-C 111.891 -0.483 . . . . 0.0 111.891 172.596 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.1 t -89.78 -155.73 0.38 Allowed 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 125.294 1.438 . . . . 0.0 109.75 -175.32 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -53.81 133.77 56.69 Favored Pre-proline 0 N--CA 1.486 1.363 0 C-N-CA 123.939 0.895 . . . . 0.0 110.78 175.869 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -54.02 138.1 69.97 Favored 'Trans proline' 0 C--N 1.387 2.563 0 C-N-CA 123.325 2.683 . . . . 0.0 112.457 -177.968 . . . . . . . . 1 1 . 1 . 011 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 N--CA 1.479 1.016 0 C-N-CA 125.125 1.37 . . . . 0.0 110.668 -174.214 . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.3 mtt . . . . . 0 N--CA 1.486 1.352 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 012 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.11 -12.75 78.73 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 116.02 -0.536 . . . . 0.0 113.273 177.635 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.0 t60 65.24 9.55 5.71 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.431 1.093 . . . . 0.0 112.688 175.715 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 66.79 -71.39 0.1 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.949 1.3 . . . . 0.0 109.542 -167.998 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -84.79 130.78 34.63 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.847 0.859 . . . . 0.0 109.045 174.733 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.1 m-70 -82.54 -14.12 55.46 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.073 0.549 . . . . 0.0 112.034 -174.729 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -96.07 114.14 25.81 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 175.109 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -64.93 -29.08 70.0 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.875 0.87 . . . . 0.0 110.883 177.483 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.6 p -56.8 118.78 5.25 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.219 1.008 . . . . 0.0 110.817 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -68.54 -17.53 64.17 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 123.952 0.901 . . . . 0.0 111.516 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 12.6 tpt 67.62 90.38 0.1 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.743 1.217 . . . . 0.0 108.921 -171.897 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.55 104.11 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.765 1.226 . . . . 0.0 111.156 -177.181 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -146.95 97.98 4.13 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 123.608 0.763 . . . . 0.0 110.754 -176.654 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -88.99 12.69 2.67 Favored 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.258 2.638 . . . . 0.0 111.257 159.135 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.37 -84.05 0.1 Allowed Glycine 0 C--N 1.347 1.153 0 CA-C-N 114.131 -1.395 . . . . 0.0 112.5 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -57.32 -50.52 72.68 Favored 'General case' 0 C--O 1.21 -1.017 0 C-N-CA 123.345 0.658 . . . . 0.0 110.917 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.22 -37.88 88.67 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 124.016 0.822 . . . . 0.0 110.693 -173.17 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.15 -48.84 76.39 Favored Glycine 0 C--N 1.353 1.523 0 O-C-N 123.527 0.517 . . . . 0.0 114.275 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -64.98 -40.5 95.07 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.309 0.576 . . . . 0.0 110.028 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.417 HD12 HG21 ' A' ' 54' ' ' VAL . 2.9 tm? -62.0 -42.72 99.46 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.436 1.495 . . . . 0.0 110.215 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.05 -40.0 95.32 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.334 1.054 . . . . 0.0 110.398 177.64 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.71 -43.16 97.41 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.532 177.91 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.433 ' O ' HG23 ' A' ' 27' ' ' VAL . 42.8 mmm-85 -66.26 -45.4 80.69 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.564 0.746 . . . . 0.0 111.394 -177.458 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.522 HG21 HD21 ' A' ' 55' ' ' LEU . 75.5 mt -57.07 -45.41 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 123.952 0.782 . . . . 0.0 109.689 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.638 HD21 ' HB3' ' A' ' 63' ' ' LYS . 66.5 mt -65.0 -38.06 89.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.607 0.567 . . . . 0.0 111.169 -179.265 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -69.42 -44.24 71.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.895 0.747 . . . . 0.0 109.983 -174.838 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 23' ' ' ARG . 98.5 t -58.85 -46.13 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.306 1.043 . . . . 0.0 110.793 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.39 -34.11 77.23 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.328 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -76.56 -45.28 31.22 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.815 0.446 . . . . 0.0 110.714 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 46.0 mt-10 -68.53 -42.12 78.91 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.923 0.489 . . . . 0.0 110.628 -175.948 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.18 -42.06 76.49 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.236 0.96 . . . . 0.0 111.758 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.75 28.06 71.03 Favored Glycine 0 C--N 1.35 1.346 0 O-C-N 123.61 0.568 . . . . 0.0 112.311 -176.03 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.7 p -161.38 154.56 17.8 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.541 1.137 . . . . 0.0 108.693 -172.88 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.457 ' HB3' HG21 ' A' ' 67' ' ' THR . 29.4 Cg_endo -60.86 124.35 14.78 Favored 'Trans proline' 0 C--N 1.374 1.916 0 C-N-CA 122.721 2.281 . . . . 0.0 112.426 178.011 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 72.8 t -105.41 128.06 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.9 mttt -68.29 150.6 48.05 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 41' ' ' VAL . 40.2 tp -56.94 -40.11 75.78 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.44 0.696 . . . . 0.0 110.071 174.434 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.09 -52.83 6.89 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.879 1.272 . . . . 0.0 112.227 167.001 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.457 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 62.4 tt0 -75.39 -25.32 57.53 Favored 'General case' 0 C--O 1.207 -1.167 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.573 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.25 -35.16 80.17 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.73 0.696 . . . . 0.0 110.525 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 37' ' ' LEU . 59.9 t -60.0 -43.03 91.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 C-N-CA 123.499 0.72 . . . . 0.0 110.082 172.399 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -66.82 -57.46 6.99 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.387 1.075 . . . . 0.0 111.017 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -65.37 -53.57 41.5 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.551 1.14 . . . . 0.0 112.415 -174.094 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.2 t -81.36 -12.8 58.89 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 122.732 0.413 . . . . 0.0 110.916 -175.204 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 67.19 13.39 9.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.3 1.44 . . . . 0.0 112.443 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -97.07 153.93 38.34 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 124.275 1.03 . . . . 0.0 111.086 -173.856 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.63 135.82 47.1 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.998 2.465 . . . . 0.0 112.285 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -44.51 -46.09 9.62 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.573 1.149 . . . . 0.0 113.296 174.936 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -60.71 -39.97 90.52 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.208 0.603 . . . . 0.0 112.134 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -66.47 -50.81 62.08 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.294 0.371 . . . . 0.0 110.521 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 36.6 mt -57.38 -57.22 13.6 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 124.168 0.918 . . . . 0.0 110.395 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.408 ' HA ' HD12 ' A' ' 55' ' ' LEU . 27.8 t-20 -51.03 -52.16 45.87 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.24 1.416 . . . . 0.0 112.097 -177.547 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -57.79 -46.53 84.48 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.188 0.595 . . . . 0.0 111.852 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.417 HG21 HD12 ' A' ' 20' ' ' LEU . 90.7 t -63.72 -37.55 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 O-C-N 123.297 0.373 . . . . 0.0 110.141 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.522 HD21 HG21 ' A' ' 24' ' ' ILE . 30.3 mt -58.18 -30.67 66.59 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.488 1.115 . . . . 0.0 113.147 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 56' ' ' TYR . . . . . 0.501 ' HA ' ' HG2' ' A' ' 59' ' ' LYS . 18.7 m-85 -75.84 -25.42 56.23 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-N 119.348 0.976 . . . . 0.0 111.808 176.156 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.468 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.1 tmt_? -70.11 -50.91 36.01 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 171.107 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 85.2 mtp -61.69 -38.82 89.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.783 1.233 . . . . 0.0 112.345 -175.335 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 56' ' ' TYR . 17.5 ptpt -65.56 -37.18 85.96 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 120.785 0.326 . . . . 0.0 111.185 -176.937 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -68.44 -30.67 69.6 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.572 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 11.7 mm-40 -80.82 0.46 34.84 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.269 0.627 . . . . 0.0 111.237 176.113 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 68.23 17.44 9.33 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 125.053 1.341 . . . . 0.0 111.714 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.638 ' HB3' HD21 ' A' ' 25' ' ' LEU . 99.4 mttt -77.66 -37.02 50.78 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.347 0.659 . . . . 0.0 111.702 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.72 146.94 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 CA-C-O 121.719 0.771 . . . . 0.0 111.303 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.7 m -109.29 134.05 52.28 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.968 1.307 . . . . 0.0 109.721 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -96.85 102.37 14.14 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 67' ' ' THR . . . . . 0.457 HG21 ' HB3' ' A' ' 34' ' ' PRO . 9.3 t -92.91 -32.94 14.4 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.257 -171.53 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.772 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.7 m -139.99 158.0 68.2 Favored Pre-proline 0 N--CA 1.478 0.96 0 CA-C-O 117.23 -1.367 . . . . 0.0 108.101 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -25.57 -70.12 0.04 OUTLIER 'Trans proline' 0 C--N 1.393 2.887 1 C-N-CA 125.589 4.193 . . . . 0.0 116.323 -175.025 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.41 17.19 20.37 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.792 0.837 . . . . 0.0 112.275 176.527 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.772 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 42.2 m -109.22 128.98 55.49 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 121.345 0.593 . . . . 0.0 110.439 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.442 ' CE2' HD13 ' A' ' 55' ' ' LEU . 73.9 m95 -112.31 168.19 9.82 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.485 1.114 . . . . 0.0 109.235 -175.242 . . . . . . . . 2 2 . 1 . 012 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 44.6 t -151.36 166.16 31.85 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.673 1.189 . . . . 0.0 108.391 178.134 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 42.6 tp -64.29 133.75 53.34 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.59 79.08 0.34 Allowed Glycine 0 C--N 1.348 1.223 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 172.435 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 132.63 45.38 0.13 Allowed Glycine 0 C--N 1.332 0.343 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 -167.834 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.7 t -60.72 -29.94 69.66 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.284 1.034 . . . . 0.0 111.652 -176.866 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -60.35 117.91 28.7 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.058 0.943 . . . . 0.0 110.734 177.778 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.62 99.17 0.61 Allowed 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.528 2.152 . . . . 0.0 110.278 175.195 . . . . . . . . 1 1 . 1 . 012 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.345 -169.948 . . . . . . . . 0 0 . 1 . 013 nuclear build full ' A' A ' 1' ' ' MET . . . . . 0.434 ' HB3' ' HB3' ' A' ' 5' ' ' HIS . 25.7 mmt . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 . . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 2' ' ' GLY . . . . . 0.413 ' O ' ' HB3' ' A' ' 7' ' ' HIS . . . -105.38 -83.56 1.67 Allowed Glycine 0 C--N 1.347 1.164 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -69.04 -43.7 74.18 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.183 0.593 . . . . 0.0 109.883 179.367 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 -85.01 131.97 34.4 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.214 171.443 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 5' ' ' HIS . . . . . 0.434 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 50.6 t60 69.57 151.4 0.09 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.56 1.144 . . . . 0.0 111.364 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -45.05 102.77 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.897 1.279 . . . . 0.0 111.999 178.862 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 7' ' ' HIS . . . . . 0.413 ' HB3' ' O ' ' A' ' 2' ' ' GLY . 29.3 p80 -65.74 150.11 49.04 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.413 177.388 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -146.89 -60.42 0.29 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.634 0.374 . . . . 0.0 111.68 -176.498 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.3 t 58.57 -160.55 0.26 Allowed 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.701 0.801 . . . . 0.0 110.745 -175.03 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -127.78 -69.58 0.73 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.493 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 49.6 ttp -170.69 -28.88 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.209 0.604 . . . . 0.0 111.501 -177.09 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.94 111.4 0.55 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.414 1.086 . . . . 0.0 112.178 -170.789 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.76 136.81 96.88 Favored Pre-proline 0 N--CA 1.477 0.918 0 C-N-CA 124.561 1.145 . . . . 0.0 111.288 -171.306 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.2 77.11 1.64 Allowed 'Trans proline' 0 C--N 1.382 2.302 0 C-N-CA 123.098 2.532 . . . . 0.0 111.576 177.414 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -173.46 155.24 21.93 Favored Glycine 0 C--O 1.249 1.036 0 N-CA-C 107.931 -2.068 . . . . 0.0 107.931 -175.622 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 16' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 34.2 ptt180 -59.39 -35.93 74.85 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -172.535 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HG3' HG22 ' A' ' 54' ' ' VAL . 44.8 tt0 -68.85 -57.01 6.16 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.042 0.937 . . . . 0.0 112.619 -173.608 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -55.63 -38.16 70.66 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.242 0.339 . . . . 0.0 113.797 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 13.3 m-70 -73.6 -36.56 65.53 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.02 0.528 . . . . 0.0 110.648 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.58 HD11 HD23 ' A' ' 51' ' ' LEU . 2.4 tm? -62.52 -45.39 93.2 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.202 1.001 . . . . 0.0 109.905 177.081 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.34 -44.78 88.89 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.498 1.119 . . . . 0.0 110.444 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 15.9 mm100 -60.02 -39.79 87.08 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 124.059 0.849 . . . . 0.0 111.953 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.417 ' O ' HG23 ' A' ' 27' ' ' VAL . 23.0 tpt180 -68.37 -41.71 80.22 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-O 119.64 -0.219 . . . . 0.0 110.691 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.5 mt -61.51 -47.69 92.22 Favored 'Isoleucine or valine' 0 C--N 1.358 0.956 0 O-C-N 123.316 0.385 . . . . 0.0 110.202 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.498 HD21 ' HB3' ' A' ' 63' ' ' LYS . 95.8 mt -52.69 -44.06 66.01 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.749 0.82 . . . . 0.0 111.923 174.654 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.15 -54.7 25.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.78 0.675 . . . . 0.0 110.768 -177.527 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 23' ' ' ARG . 90.5 t -56.25 -45.86 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.187 0.995 . . . . 0.0 111.434 -177.056 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.604 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.9 mt -64.79 -35.84 82.4 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 123.637 0.586 . . . . 0.0 111.536 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -66.45 -46.18 77.32 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.874 0.469 . . . . 0.0 111.043 176.355 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.53 -40.33 80.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.153 0.581 . . . . 0.0 111.184 -174.229 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.55 87.84 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.006 0.523 . . . . 0.0 110.318 172.318 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.12 37.55 94.13 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.084 -177.587 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.1 t -164.6 152.09 10.21 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.501 0.72 . . . . 0.0 109.682 -167.488 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -50.26 126.53 17.66 Favored 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 123.14 2.56 . . . . 0.0 113.177 168.336 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 69.0 t -118.22 128.87 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.364 1.066 . . . . 0.0 108.31 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 56.4 mtmt -65.11 150.63 47.81 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 123.366 0.416 . . . . 0.0 110.401 176.152 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.444 ' O ' HG23 ' A' ' 41' ' ' VAL . 22.6 tp -61.94 -46.94 87.14 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.648 0.593 . . . . 0.0 110.761 176.46 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.68 -31.54 26.22 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.3 tt0 -80.24 -37.0 33.9 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.668 0.387 . . . . 0.0 110.292 174.436 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.03 -31.85 69.2 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.619 0.767 . . . . 0.0 110.774 178.656 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.49 ' HA ' HD11 ' A' ' 51' ' ' LEU . 25.0 t -54.72 -54.2 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 123.512 0.507 . . . . 0.0 111.493 176.807 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -74.6 -44.66 49.65 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.452 0.47 . . . . 0.0 111.965 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 34.0 mm-40 -59.26 -54.87 41.93 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.3 t -75.21 -16.53 60.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.233 0.613 . . . . 0.0 111.105 -178.711 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 65.21 23.17 12.24 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.2 1.4 . . . . 0.0 112.253 177.795 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.17 151.01 45.3 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.115 0.966 . . . . 0.0 109.831 -178.485 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.62 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 19.9 Cg_endo -59.75 136.59 71.43 Favored 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 122.681 2.254 . . . . 0.0 111.921 174.61 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -47.95 -33.24 7.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.991 1.316 . . . . 0.0 113.285 176.15 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.62 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 14.2 ptp180 -59.78 -46.31 89.57 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.177 0.591 . . . . 0.0 111.037 177.218 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.481 ' HG3' ' HG ' ' A' ' 20' ' ' LEU . 10.3 tp10 -67.09 -49.96 63.22 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.98 0.912 . . . . 0.0 110.521 -178.993 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.58 HD23 HD11 ' A' ' 20' ' ' LEU . 48.2 mt -56.45 -54.07 50.01 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.93 -179.362 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -51.29 -49.51 61.12 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.084 1.353 . . . . 0.0 112.171 -176.745 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.352 0.709 0 O-C-N 123.88 0.738 . . . . 0.0 111.821 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.424 ' O ' ' HG3' ' A' ' 58' ' ' MET . 78.1 t -68.82 -36.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 122.545 0.338 . . . . 0.0 110.785 -176.876 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.4 mt -52.68 -37.88 59.56 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.319 1.048 . . . . 0.0 112.917 173.078 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -70.16 -31.48 68.99 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.642 0.655 . . . . 0.0 111.513 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -64.1 -52.43 59.25 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.424 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 74.9 mtp -62.02 -33.44 74.37 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 124.152 0.981 . . . . 0.0 111.336 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -62.42 -42.31 99.35 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.574 0.749 . . . . 0.0 111.908 175.233 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -69.52 -22.56 63.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.267 0.627 . . . . 0.0 111.273 173.533 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.406 ' HB3' ' HE3' ' A' ' 63' ' ' LYS . 18.6 mm-40 -89.1 -0.28 57.31 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.446 0.698 . . . . 0.0 111.309 173.079 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 65.48 11.17 7.19 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 125.027 1.331 . . . . 0.0 112.43 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.498 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.7 mttt -74.53 -34.82 63.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.869 0.868 . . . . 0.0 111.2 -178.836 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.4 m -128.9 147.07 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.229 0.612 . . . . 0.0 109.637 175.49 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 65' ' ' SER . . . . . 0.631 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 49.0 m -121.0 156.28 32.48 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.962 0.905 . . . . 0.0 109.459 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.7 tp -104.17 103.31 13.07 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.7 t -95.68 -36.4 11.22 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.366 0.666 . . . . 0.0 111.127 -169.143 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.567 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.1 m -139.34 166.8 21.89 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 123.584 0.754 . . . . 0.0 109.469 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -51.06 106.92 0.15 Allowed 'Trans proline' 0 C--N 1.39 2.731 0 C-N-CA 123.177 2.585 . . . . 0.0 113.195 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 66.11 21.31 11.19 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.569 1.148 . . . . 0.0 111.933 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 29.2 m -120.14 122.75 41.71 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 123.937 0.895 . . . . 0.0 108.771 -177.849 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -106.99 169.01 8.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.631 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 24.6 p -150.74 158.49 44.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.575 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.604 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 18.7 tp -78.26 105.07 9.25 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.07 -58.58 10.34 Favored Glycine 0 C--N 1.345 1.033 0 O-C-N 123.843 0.715 . . . . 0.0 111.327 176.774 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.18 79.03 1.95 Allowed Glycine 0 C--N 1.34 0.756 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 171.842 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.402 ' HA ' HD23 ' A' ' 74' ' ' LEU . 7.7 m -69.87 85.64 0.5 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.742 0.817 . . . . 0.0 111.579 -173.354 . . . . . . . . 2 2 . 1 . 013 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.5 t70 55.47 68.69 2.31 Favored Pre-proline 0 CA--C 1.557 1.219 0 C-N-CA 124.892 1.277 . . . . 0.0 110.879 177.256 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -73.54 94.85 0.85 Allowed 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 122.752 2.301 . . . . 0.0 113.968 -168.265 . . . . . . . . 1 1 . 1 . 013 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 . . . . . 0 CA--C 1.557 1.229 0 CA-C-O 118.542 -0.742 . . . . 0.0 110.389 175.445 . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.7 mtt . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 . . . . . . . . . 0 0 . 1 . 014 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.15 19.79 2.3 Favored Glycine 0 C--N 1.353 1.473 0 CA-C-O 119.967 -0.351 . . . . 0.0 113.754 -174.648 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -123.84 111.88 16.62 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 172.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -104.33 -5.39 21.83 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -110.41 92.0 3.88 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 175.982 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -156.34 11.93 0.28 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.408 1.083 . . . . 0.0 109.222 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -57.05 -69.54 0.15 Allowed 'General case' 0 C--N 1.357 0.899 0 C-N-CA 123.698 0.799 . . . . 0.0 111.485 -168.729 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.2 m80 58.76 -75.86 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 125.015 1.326 . . . . 0.0 112.093 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.1 m -49.14 127.49 14.67 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.088 1.355 . . . . 0.0 112.574 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.5 m-70 -88.31 29.79 0.94 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.924 0.89 . . . . 0.0 111.836 -175.317 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 50.0 ttm -138.98 -58.84 0.6 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.672 0.789 . . . . 0.0 109.091 177.643 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.26 87.25 1.97 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.358 0.663 . . . . 0.0 110.692 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.6 135.67 43.17 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 123.763 0.825 . . . . 0.0 109.945 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -79.68 4.56 6.58 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 123.2 2.6 . . . . 0.0 113.302 -179.0 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -29.25 89.77 0.01 OUTLIER Glycine 0 C--N 1.356 1.658 0 O-C-N 125.285 1.615 . . . . 0.0 114.697 174.915 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.4 mtp-105 -54.4 -15.27 1.56 Allowed 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -168.41 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -56.11 -43.31 78.0 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -156.763 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -69.81 -40.27 75.47 Favored Glycine 0 C--N 1.35 1.33 0 N-CA-C 115.541 0.976 . . . . 0.0 115.541 177.253 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -72.89 -37.95 67.13 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.006 0.908 . . . . 0.0 110.149 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.648 HD11 HD23 ' A' ' 51' ' ' LEU . 3.0 tm? -66.15 -36.43 83.11 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 113.378 -1.737 . . . . 0.0 110.156 174.247 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.421 ' HG3' ' HG2' ' A' ' 58' ' ' MET . 34.6 tt0 -60.64 -46.16 91.35 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.316 1.046 . . . . 0.0 110.32 174.105 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 69.8 mt-30 -65.98 -32.62 74.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.438 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.503 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -66.74 -48.66 68.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.48 0.712 . . . . 0.0 109.353 176.949 . . . . . . . . 3 3 . 1 . 014 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.437 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.2 mt -57.65 -49.17 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 124.275 0.984 . . . . 0.0 109.878 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.509 HD21 ' HB3' ' A' ' 63' ' ' LYS . 78.2 mt -55.8 -40.15 72.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 123.596 0.758 . . . . 0.0 110.832 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -70.87 -41.48 71.31 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 123.865 0.728 . . . . 0.0 110.692 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 23' ' ' ARG . 60.5 t -54.69 -46.34 73.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.298 0.639 . . . . 0.0 110.221 174.692 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 71.2 mt -65.26 -39.76 93.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.253 -178.665 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -69.58 -48.48 60.04 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.279 1.032 . . . . 0.0 112.043 -177.472 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.99 -36.15 81.54 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.616 0.766 . . . . 0.0 110.237 -176.703 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.73 87.51 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.782 171.983 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 24.31 70.34 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.951 -171.272 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -153.35 149.56 21.75 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.413 1.085 . . . . 0.0 109.36 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -55.17 114.66 1.97 Allowed 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.533 2.156 . . . . 0.0 112.277 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.449 HG21 HG12 ' A' ' 27' ' ' VAL . 91.7 t -96.04 131.5 42.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.777 0.831 . . . . 0.0 108.924 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 46.2 mtpt -73.12 151.27 41.66 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.04 0.536 . . . . 0.0 109.943 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.484 ' O ' HG23 ' A' ' 41' ' ' VAL . 36.2 tp -54.09 -44.74 71.47 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.394 1.058 . . . . 0.0 111.199 178.515 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.89 -49.18 11.11 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.043 0.937 . . . . 0.0 112.627 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.43 ' HA ' ' HG2' ' A' ' 42' ' ' LYS . 52.1 tt0 -77.07 -28.18 54.55 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.595 0.358 . . . . 0.0 110.807 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.14 -32.27 73.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.336 0.255 . . . . 0.0 110.358 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.553 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.2 t -59.68 -55.44 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.302 0.641 . . . . 0.0 110.786 175.137 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HG2' ' HA ' ' A' ' 39' ' ' GLN . 20.3 ptmt -69.9 -42.26 73.63 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.601 -174.018 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -72.47 -36.25 68.41 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.8 m -83.75 -17.04 42.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 117.866 0.303 . . . . 0.0 111.443 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 58.94 27.53 16.4 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.533 1.133 . . . . 0.0 111.82 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.68 154.9 54.98 Favored Pre-proline 0 C--O 1.245 0.854 0 C-N-CA 124.283 1.033 . . . . 0.0 109.963 -174.433 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.43 131.13 30.66 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.504 2.136 . . . . 0.0 111.864 177.916 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.544 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.5 ttmt -45.23 -41.05 8.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.486 1.515 . . . . 0.0 113.239 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -53.81 -49.4 68.45 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.816 0.846 . . . . 0.0 111.264 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.97 -44.25 96.56 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 123.467 0.707 . . . . 0.0 110.773 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 20' ' ' LEU . 75.1 mt -54.73 -51.07 66.78 Favored 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.513 1.133 . . . . 0.0 110.671 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.38 -54.73 23.61 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.257 0.973 . . . . 0.0 112.311 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -53.57 -44.89 69.68 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.663 HG12 ' SD ' ' A' ' 58' ' ' MET . 94.8 t -66.37 -51.1 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 122.869 0.467 . . . . 0.0 110.789 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.437 HD13 ' NE1' ' A' ' 72' ' ' TRP . 57.7 mt -48.63 -49.62 36.39 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.509 1.524 . . . . 0.0 114.537 -176.744 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -69.35 -29.43 67.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.451 0.301 . . . . 0.0 111.421 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -67.57 -47.76 68.86 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 174.069 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.663 ' SD ' HG12 ' A' ' 54' ' ' VAL . 73.2 mtp -60.58 -34.06 73.62 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.908 0.883 . . . . 0.0 110.927 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 59' ' ' LYS . . . . . 0.404 ' HB2' ' HZ3' ' A' ' 72' ' ' TRP . 58.2 tttm -64.78 -42.62 94.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.748 0.819 . . . . 0.0 110.82 177.28 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -59.91 -44.05 94.51 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.74 0.816 . . . . 0.0 110.423 172.819 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -78.92 -1.28 34.5 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.469 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt 62.93 15.72 8.58 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 125.343 1.457 . . . . 0.0 112.28 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.509 ' HB3' HD21 ' A' ' 25' ' ' LEU . 92.4 mttt -67.96 -33.24 74.27 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.573 1.149 . . . . 0.0 109.868 173.463 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 28.9 m -129.1 169.43 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.265 0.626 . . . . 0.0 109.451 173.498 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.9 t -134.05 147.32 50.91 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 176.638 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.4 tp -100.54 106.28 17.78 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 35.1 p -93.7 -34.29 13.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.636 0.774 . . . . 0.0 111.772 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.663 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 47.6 t -141.15 154.65 68.07 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -21.68 -67.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.394 2.957 1 C-N-CA 125.594 4.196 . . . . 0.0 116.513 -177.149 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.08 51.69 1.42 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.489 0.661 . . . . 0.0 110.538 173.218 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.663 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 69.3 m -131.87 128.57 38.9 Favored 'General case' 0 C--O 1.243 0.711 0 C-N-CA 123.647 0.779 . . . . 0.0 109.541 172.045 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.437 ' NE1' HD13 ' A' ' 55' ' ' LEU . 75.2 m95 -117.67 142.22 47.49 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.789 0.836 . . . . 0.0 109.701 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 38.7 t -115.87 166.31 12.11 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.585 0.754 . . . . 0.0 109.848 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.83 129.6 40.39 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.708 0.803 . . . . 0.0 109.428 174.861 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.02 92.76 0.56 Allowed Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 175.821 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 86.68 178.89 49.24 Favored Glycine 0 C--N 1.345 1.057 0 N-CA-C 111.853 -0.499 . . . . 0.0 111.853 -175.039 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 44.7 m -78.52 -44.43 24.4 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 121.457 0.646 . . . . 0.0 109.763 178.829 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -133.32 137.03 28.26 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.131 -176.074 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.52 113.71 3.85 Favored 'Trans proline' 0 C--N 1.372 1.764 0 C-N-CA 122.352 2.035 . . . . 0.0 111.064 171.046 . . . . . . . . 1 1 . 1 . 014 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.249 0 CA-C-O 118.724 -0.655 . . . . 0.0 109.994 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.0 mtm . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 015 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.03 -27.05 65.13 Favored Glycine 0 C--N 1.355 1.588 0 CA-C-N 116.029 -0.532 . . . . 0.0 113.465 -176.617 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.3 m170 -76.35 -0.53 22.94 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.233 0.613 . . . . 0.0 112.127 177.389 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -67.83 141.66 56.4 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 m170 68.28 97.56 0.06 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.719 1.208 . . . . 0.0 109.236 -169.18 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.4 t60 -70.85 116.7 11.46 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.109 0.563 . . . . 0.0 110.754 -176.23 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -94.13 165.78 12.45 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.738 0.815 . . . . 0.0 109.759 170.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -153.7 160.91 42.49 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.11 0.564 . . . . 0.0 110.278 177.339 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.2 t -115.85 125.2 52.34 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.897 0.879 . . . . 0.0 108.951 179.313 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 68.1 t60 -65.23 -53.03 50.57 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.78 0.832 . . . . 0.0 110.635 -176.131 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.9 ptm -84.47 72.36 10.63 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 122.409 1.099 . . . . 0.0 109.726 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.48 21.56 0.15 Allowed 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.028 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 76.6 115.68 0.03 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 126.222 1.809 . . . . 0.0 110.226 -172.572 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.54 -36.94 61.66 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 123.591 2.86 . . . . 0.0 112.732 173.078 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -153.6 114.15 0.61 Allowed Glycine 0 C--N 1.337 0.609 0 N-CA-C 107.999 -2.04 . . . . 0.0 107.999 167.249 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -59.39 -34.36 72.34 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.709 0.804 . . . . 0.0 112.014 -169.156 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.47 -50.61 69.01 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.737 0.815 . . . . 0.0 109.67 -178.123 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 22' ' ' GLN . . . -51.51 -38.22 42.44 Favored Glycine 0 C--N 1.346 1.117 0 O-C-N 123.77 0.669 . . . . 0.0 114.442 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -83.39 -32.62 26.07 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.393 0.277 . . . . 0.0 110.817 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' A' ' 51' ' ' LEU . 0.8 OUTLIER -60.35 -53.11 61.54 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.454 1.102 . . . . 0.0 108.937 178.433 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.757 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.6 tt0 -59.48 -47.46 85.41 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.551 176.011 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -60.59 -41.18 94.17 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 123.784 0.678 . . . . 0.0 109.963 -173.463 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.405 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -64.51 -49.62 70.62 Favored 'General case' 0 C--N 1.346 0.426 0 C-N-CA 123.666 0.787 . . . . 0.0 111.968 -178.941 . . . . . . . . 3 3 . 1 . 015 nuclear build full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 76.1 mt -58.62 -49.52 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 124.056 0.848 . . . . 0.0 110.152 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.51 -38.76 91.18 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 123.586 0.754 . . . . 0.0 111.286 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -70.92 -41.41 71.25 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.47 0.481 . . . . 0.0 110.573 -176.693 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 23' ' ' ARG . 86.7 t -63.31 -37.52 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.105 0.562 . . . . 0.0 110.338 176.68 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.511 HD22 ' HA ' ' A' ' 73' ' ' CYS . 89.5 mt -71.09 -28.94 64.7 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.767 0.427 . . . . 0.0 111.123 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 99.0 m -73.6 -49.58 25.49 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.048 0.939 . . . . 0.0 111.632 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -66.85 -32.08 73.11 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.158 0.583 . . . . 0.0 110.572 -176.2 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.32 -47.73 80.98 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.918 169.971 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.66 27.29 69.61 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.975 0.797 . . . . 0.0 111.332 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.4 t -160.5 151.13 15.29 Favored Pre-proline 0 C--O 1.245 0.86 0 C-N-CA 124.478 1.111 . . . . 0.0 109.238 -166.155 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -56.52 123.83 14.78 Favored 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 122.738 2.292 . . . . 0.0 112.209 172.575 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 88.0 t -113.62 137.21 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.475 1.11 . . . . 0.0 108.61 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 95.1 mttt -75.1 148.56 39.62 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 123.221 0.608 . . . . 0.0 109.456 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.505 ' O ' HG23 ' A' ' 41' ' ' VAL . 45.6 tp -54.01 -43.09 69.77 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 124.544 1.152 . . . . 0.0 111.013 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -43.2 -51.06 6.25 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.502 1.121 . . . . 0.0 113.184 170.57 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -74.42 -30.91 62.11 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.931 0.493 . . . . 0.0 110.84 -179.092 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 37' ' ' LEU . 97.0 mt -61.83 -33.6 74.44 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.897 0.479 . . . . 0.0 110.192 175.895 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 37' ' ' LEU . 60.9 t -59.38 -55.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.609 0.764 . . . . 0.0 111.738 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -68.67 -41.98 78.52 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 123.853 0.721 . . . . 0.0 111.003 -174.007 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -67.81 -48.17 67.03 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.208 0.603 . . . . 0.0 112.03 -178.098 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 63.6 m -77.83 -13.67 59.81 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.004 0.521 . . . . 0.0 111.325 -177.421 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 57.69 40.57 26.39 Favored 'General case' 0 C--N 1.364 1.203 0 C-N-CA 124.253 1.021 . . . . 0.0 110.407 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.486 ' HB3' HD21 ' A' ' 51' ' ' LEU . . . -138.6 154.29 73.14 Favored Pre-proline 0 CA--C 1.553 1.075 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.599 -172.509 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -60.61 129.06 27.88 Favored 'Trans proline' 0 C--N 1.381 2.269 0 C-N-CA 123.198 2.598 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -41.0 -48.82 3.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.178 1.391 . . . . 0.0 114.08 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 82.1 mtm180 -59.24 -45.45 91.13 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 123.87 0.731 . . . . 0.0 111.061 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.06 -46.28 81.83 Favored 'General case' 0 C--O 1.241 0.622 0 O-C-N 123.957 0.786 . . . . 0.0 109.661 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.576 ' HA ' HD11 ' A' ' 20' ' ' LEU . 81.3 mt -56.1 -49.86 72.66 Favored 'General case' 0 C--N 1.356 0.874 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.927 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.403 ' HA ' HD12 ' A' ' 55' ' ' LEU . 16.2 t30 -63.15 -43.4 98.42 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.385 1.053 . . . . 0.0 112.698 -173.997 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 78.8 mm-40 -60.97 -45.39 94.97 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 120.573 0.225 . . . . 0.0 111.058 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.5 t -66.17 -38.33 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.341 0.656 . . . . 0.0 110.705 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 52' ' ' ASN . 14.7 mt -53.1 -39.64 63.54 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.684 1.193 . . . . 0.0 112.767 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -68.03 -35.31 78.06 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 118.417 0.553 . . . . 0.0 112.033 179.129 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.492 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 66.1 ttp85 -68.01 -50.34 56.07 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.757 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 69.6 mtm -62.27 -28.39 69.68 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.989 0.806 . . . . 0.0 111.678 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -71.84 -38.91 70.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -63.44 -39.91 95.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.304 0.642 . . . . 0.0 110.414 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.33 -2.54 45.8 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.759 0.824 . . . . 0.0 111.436 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.1 mt 68.59 10.33 7.82 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.155 1.382 . . . . 0.0 112.529 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 64.5 mttm -64.66 -32.02 73.5 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.875 0.87 . . . . 0.0 110.416 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 18.5 m -130.62 165.37 31.1 Favored 'Isoleucine or valine' 0 C--O 1.245 0.834 0 C-N-CA 124.106 0.962 . . . . 0.0 109.115 172.678 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 t -143.44 145.13 32.36 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.5 tp -95.7 103.88 15.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.151 0.58 . . . . 0.0 109.546 -172.741 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 33.5 p -84.16 -45.62 12.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.572 0.749 . . . . 0.0 112.082 -174.205 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.477 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 17.8 m -132.29 169.43 13.91 Favored Pre-proline 0 N--CA 1.479 0.999 0 CA-C-O 117.44 -1.267 . . . . 0.0 107.587 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 2.3 Cg_exo -29.09 -78.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 124.689 3.593 . . . . 0.0 115.266 178.529 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -100.18 19.52 16.31 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 118.89 0.768 . . . . 0.0 112.026 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 20.6 m -107.97 125.85 52.01 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.134 0.492 . . . . 0.0 109.859 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.16 168.35 10.19 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.511 ' HA ' HD22 ' A' ' 28' ' ' LEU . 35.4 t -149.06 164.41 34.72 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.885 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.618 ' HG ' ' H ' ' A' ' 76' ' ' GLY . 40.1 tp -65.98 143.82 57.14 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.529 0.518 . . . . 0.0 109.724 175.898 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.49 -18.4 71.69 Favored Glycine 0 C--N 1.344 0.993 0 O-C-N 123.649 0.593 . . . . 0.0 113.249 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 76' ' ' GLY . . . . . 0.618 ' H ' ' HG ' ' A' ' 74' ' ' LEU . . . -78.88 -10.4 86.22 Favored Glycine 0 C--N 1.344 1.008 0 CA-C-O 119.62 -0.545 . . . . 0.0 114.115 175.544 . . . . . . . . 2 2 . 1 . 015 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.6 m -80.11 83.18 6.03 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-O 121.258 0.551 . . . . 0.0 109.833 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.86 131.04 38.55 Favored Pre-proline 0 N--CA 1.476 0.844 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.469 179.367 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.22 118.25 4.63 Favored 'Trans proline' 0 C--N 1.369 1.609 0 C-N-CA 122.436 2.09 . . . . 0.0 110.558 171.426 . . . . . . . . 1 1 . 1 . 015 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 CA--C 1.549 0.941 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 175.23 . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 mtt . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 0 0 . 1 . 016 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.55 -97.89 0.72 Allowed Glycine 0 C--N 1.349 1.279 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.914 -175.315 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -97.72 -42.39 7.64 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 170.566 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -146.94 -73.62 0.21 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.863 0.865 . . . . 0.0 110.731 -176.831 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -115.03 -21.76 9.88 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.827 0.851 . . . . 0.0 112.633 -172.892 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -71.35 99.31 1.93 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.416 0.686 . . . . 0.0 111.036 -174.43 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.5 p-80 -110.57 -173.77 2.32 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.441 1.096 . . . . 0.0 111.887 -174.474 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.4 m170 -60.47 106.63 0.57 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.368 1.067 . . . . 0.0 110.213 173.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.9 t -129.12 88.62 2.74 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.088 0.555 . . . . 0.0 110.484 -175.242 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -137.84 32.68 2.44 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.795 0.838 . . . . 0.0 109.946 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.8 mmt 60.18 87.52 0.09 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 124.634 1.174 . . . . 0.0 108.753 -172.687 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 64.35 -159.61 0.3 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.293 1.037 . . . . 0.0 109.349 -163.106 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -148.93 102.79 3.38 Favored Pre-proline 0 N--CA 1.471 0.606 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -102.32 111.99 0.05 OUTLIER 'Trans proline' 0 CA--C 1.561 1.843 0 C-N-CA 123.665 2.91 . . . . 0.0 112.443 165.755 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.32 -45.05 0.44 Allowed Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.366 -0.693 . . . . 0.0 111.366 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.37 -33.18 67.04 Favored 'General case' 0 C--O 1.209 -1.041 0 CA-C-O 118.449 -0.786 . . . . 0.0 112.898 178.708 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -66.59 -56.62 9.92 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 -160.494 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 18' ' ' GLY . . . . . 0.439 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -66.3 -27.59 73.13 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-O 120.145 -0.253 . . . . 0.0 113.315 177.127 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -73.76 -35.15 64.97 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.637 0.775 . . . . 0.0 109.163 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.5 HD12 HG21 ' A' ' 54' ' ' VAL . 2.8 tm? -66.88 -39.36 87.46 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.784 1.634 . . . . 0.0 108.978 176.335 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -66.71 -38.44 86.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.965 0.906 . . . . 0.0 110.202 177.199 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 22' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 56.0 mt-30 -62.69 -40.19 96.33 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.879 0.872 . . . . 0.0 110.455 174.228 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -68.52 -42.87 77.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 123.614 0.766 . . . . 0.0 111.599 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.1 mt -58.89 -52.3 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 123.827 0.705 . . . . 0.0 109.361 177.926 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.643 HD21 ' HB3' ' A' ' 63' ' ' LYS . 91.5 mt -58.27 -40.47 81.95 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.493 0.717 . . . . 0.0 111.367 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -67.48 -49.07 65.18 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.468 0.707 . . . . 0.0 111.092 -177.294 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.44 -39.49 79.29 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.534 1.134 . . . . 0.0 111.349 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 73' ' ' CYS . 85.7 mt -67.89 -40.02 83.58 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.875 0.87 . . . . 0.0 110.915 176.619 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -68.48 -48.83 63.46 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.999 0.919 . . . . 0.0 111.426 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -71.42 -39.51 71.03 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 123.182 0.593 . . . . 0.0 110.95 -173.469 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.6 -33.63 75.38 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.505 0.503 . . . . 0.0 111.059 173.585 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.36 32.52 84.47 Favored Glycine 0 C--N 1.354 1.542 0 O-C-N 123.959 0.787 . . . . 0.0 112.771 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 p -170.31 155.86 5.31 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 124.192 0.997 . . . . 0.0 109.141 -171.348 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.561 ' HB3' ' HB2' ' A' ' 73' ' ' CYS . 20.2 Cg_endo -60.92 118.26 5.11 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.728 2.285 . . . . 0.0 112.998 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.79 135.66 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -66.11 143.75 57.12 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.511 0.724 . . . . 0.0 109.986 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.51 HD13 HD11 ' A' ' 55' ' ' LEU . 13.1 tp -61.26 -41.77 97.49 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.912 0.885 . . . . 0.0 110.67 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.5 -41.91 10.13 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.094 0.957 . . . . 0.0 113.42 167.736 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.544 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 34.6 tt0 -82.89 -29.45 29.27 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.1 mt -60.05 -34.63 73.67 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.683 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.423 ' HA ' HD11 ' A' ' 51' ' ' LEU . 91.5 t -51.8 -56.32 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 124.708 1.203 . . . . 0.0 111.701 175.206 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -71.53 -37.51 71.17 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.181 -173.727 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 9.1 mm-40 -61.38 -53.11 60.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.03 0.532 . . . . 0.0 111.704 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 46' ' ' ALA . 30.4 p -83.93 -10.32 58.05 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.113 0.565 . . . . 0.0 111.127 -176.33 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 63.67 17.59 10.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.623 1.169 . . . . 0.0 111.797 -178.87 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.528 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -107.98 151.84 41.45 Favored Pre-proline 0 N--CA 1.476 0.828 0 C-N-CA 124.134 0.974 . . . . 0.0 110.867 -175.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.3 140.24 81.82 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.548 2.165 . . . . 0.0 111.575 175.383 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -47.1 -34.32 5.88 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 124.19 0.996 . . . . 0.0 112.553 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 49' ' ' ARG . . . . . 0.44 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 20.4 tpp180 -61.82 -47.38 85.33 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.241 0.616 . . . . 0.0 111.779 177.303 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -62.66 -47.31 84.26 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 123.326 0.65 . . . . 0.0 110.249 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.492 ' HA ' HD11 ' A' ' 20' ' ' LEU . 17.3 mt -53.34 -56.46 16.53 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 124.62 1.168 . . . . 0.0 110.893 176.151 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -49.21 -52.53 26.31 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 126.091 1.757 . . . . 0.0 111.868 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 53' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 14.3 mm100 -53.42 -47.99 69.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.945 0.898 . . . . 0.0 111.667 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.5 HG21 HD12 ' A' ' 20' ' ' LEU . 85.1 t -68.32 -44.89 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.25 -179.07 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.51 HD11 HD13 ' A' ' 37' ' ' LEU . 54.6 mt -52.32 -44.51 65.14 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.496 1.518 . . . . 0.0 114.306 -177.211 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -62.89 -32.45 73.71 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.202 0.456 . . . . 0.0 111.071 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.46 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.5 mmm-85 -70.68 -49.17 50.09 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 123.03 0.532 . . . . 0.0 109.768 177.352 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 70.7 mtp -57.77 -36.12 71.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.114 0.966 . . . . 0.0 111.618 -177.159 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -59.4 -44.04 92.87 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.427 0.691 . . . . 0.0 110.246 176.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -75.29 -25.33 57.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.502 1.121 . . . . 0.0 111.81 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 7.0 mm-40 -77.83 -4.65 47.63 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.041 0.536 . . . . 0.0 110.001 170.935 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 62' ' ' LEU . . . . . 0.54 ' HB3' ' HG3' ' A' ' 80' ' ' GLU . 83.1 mt 68.32 19.19 9.04 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 125.541 1.536 . . . . 0.0 111.438 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.643 ' HB3' HD21 ' A' ' 25' ' ' LEU . 98.8 mttt -80.72 -33.42 35.26 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.782 1.233 . . . . 0.0 111.711 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.9 m -132.74 161.75 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-O 121.267 0.556 . . . . 0.0 111.189 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.6 t -132.31 145.34 51.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.904 1.281 . . . . 0.0 108.61 174.1 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 47.0 tp -95.67 109.01 21.35 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 37.3 p -84.78 -44.57 13.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.161 0.584 . . . . 0.0 111.168 -175.46 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.644 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 13.1 m -134.72 159.5 71.93 Favored Pre-proline 0 CA--C 1.555 1.141 0 CA-C-O 117.212 -1.375 . . . . 0.0 107.64 -175.852 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -29.68 -66.02 0.07 OUTLIER 'Trans proline' 0 C--N 1.396 3.059 0 C-N-CA 125.017 3.811 . . . . 0.0 116.243 -174.547 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.65 40.07 3.02 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.924 0.889 . . . . 0.0 111.084 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.644 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 91.1 m -131.2 122.82 27.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.606 0.762 . . . . 0.0 109.869 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.5 m95 -114.25 151.47 32.79 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.119 0.968 . . . . 0.0 108.698 -172.829 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.561 ' HB2' ' HB3' ' A' ' 34' ' ' PRO . 42.7 t -132.54 170.26 15.41 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.053 0.941 . . . . 0.0 109.209 177.904 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.0 tp -68.49 160.31 30.06 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.418 ' HA3' ' HB3' ' A' ' 79' ' ' PRO . . . -57.27 -32.73 64.06 Favored Glycine 0 N--CA 1.476 1.313 0 C-N-CA 122.74 0.209 . . . . 0.0 112.722 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 146.23 -171.55 27.08 Favored Glycine 0 C--N 1.346 1.138 0 C-N-CA 123.228 0.442 . . . . 0.0 112.076 173.39 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.8 t -66.01 102.37 0.79 Allowed 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 170.927 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.9 t70 58.88 86.24 0.16 Allowed Pre-proline 0 N--CA 1.486 1.356 0 C-N-CA 124.294 1.038 . . . . 0.0 109.374 -166.148 . . . . . . . . 1 1 . 1 . 016 nuclear build full ' A' A ' 79' ' ' PRO . . . . . 0.418 ' HB3' ' HA3' ' A' ' 75' ' ' GLY . 37.8 Cg_exo -58.73 105.7 0.24 Allowed 'Trans proline' 0 C--N 1.385 2.478 0 C-N-CA 123.154 2.569 . . . . 0.0 113.248 -173.801 . . . . . . . . 2 2 . 1 . 016 nuclear build full ' A' A ' 80' ' ' GLU . . . . . 0.54 ' HG3' ' HB3' ' A' ' 62' ' ' LEU . 51.3 mm-40 . . . . . 0 CA--C 1.557 1.219 0 C-N-CA 125.051 1.34 . . . . 0.0 111.701 174.289 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptp . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 017 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.41 26.31 0.09 OUTLIER Glycine 0 C--N 1.354 1.532 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.156 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -131.18 60.53 1.66 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.052 0.941 . . . . 0.0 109.153 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -159.81 100.72 1.45 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 171.951 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -62.83 96.27 0.09 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 121.264 0.554 . . . . 0.0 110.408 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -113.53 -21.61 10.74 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.923 0.889 . . . . 0.0 110.209 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -74.72 -65.81 0.82 Allowed 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 172.93 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -93.73 97.09 10.21 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.8 0.81 . . . . 0.0 109.43 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.0 t -165.33 9.37 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.5 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 76.4 m-70 -127.71 -176.14 3.68 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.274 1.03 . . . . 0.0 108.917 -174.707 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.7 150.79 41.0 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 122.544 0.338 . . . . 0.0 110.454 175.212 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.51 -167.75 0.59 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.972 0.909 . . . . 0.0 110.181 173.985 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -48.47 114.66 3.69 Favored Pre-proline 0 N--CA 1.483 1.178 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.592 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.35 -22.2 46.23 Favored 'Trans proline' 0 C--N 1.373 1.858 0 C-N-CA 122.839 2.36 . . . . 0.0 112.786 -164.675 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 117.73 106.41 2.36 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 107.865 -2.094 . . . . 0.0 107.865 -173.194 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -68.44 -29.96 68.74 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 117.391 0.595 . . . . 0.0 111.618 -169.45 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -58.32 -49.64 76.46 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.161 0.584 . . . . 0.0 109.784 171.248 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.72 -30.27 72.74 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.643 -1.162 . . . . 0.0 113.458 179.279 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -74.68 -39.1 62.2 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.475 HD12 HG21 ' A' ' 54' ' ' VAL . 2.4 tm? -65.11 -40.87 95.15 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.444 1.098 . . . . 0.0 110.403 173.332 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.739 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 19.5 tt0 -58.28 -49.97 75.26 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.313 1.445 . . . . 0.0 110.974 175.81 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -66.32 -31.6 72.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.916 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.422 ' O ' HG23 ' A' ' 27' ' ' VAL . 20.6 tpp180 -62.74 -47.15 84.82 Favored 'General case' 0 C--N 1.351 0.637 0 C-N-CA 122.944 0.498 . . . . 0.0 110.553 174.221 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 20' ' ' LEU . 68.6 mt -60.09 -46.94 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.859 0.725 . . . . 0.0 109.9 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.487 HD11 ' HD3' ' A' ' 63' ' ' LYS . 93.2 mt -62.16 -35.89 80.17 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.547 0.739 . . . . 0.0 110.97 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 26' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 29.8 tt0 -70.28 -44.66 67.94 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.885 0.741 . . . . 0.0 110.567 178.734 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 23' ' ' ARG . 55.8 t -54.23 -44.59 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.979 0.912 . . . . 0.0 110.938 174.834 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.9 mt -66.26 -37.45 85.51 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -64.22 -51.16 65.01 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.167 0.987 . . . . 0.0 111.605 177.786 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 30' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 15.7 mm-40 -63.29 -46.6 86.0 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.223 0.609 . . . . 0.0 111.444 -173.523 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.95 -38.29 90.46 Favored 'General case' 0 C--O 1.24 0.578 0 O-C-N 124.177 0.923 . . . . 0.0 110.573 178.257 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.57 -56.8 4.91 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.142 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.1 p -72.58 161.92 76.72 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 124.12 0.968 . . . . 0.0 110.835 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -50.41 142.59 29.5 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.982 2.455 . . . . 0.0 113.368 172.442 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 39.6 t -121.79 132.1 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.731 0.812 . . . . 0.0 109.426 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -69.96 148.42 48.94 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.04 0.536 . . . . 0.0 109.806 176.506 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HG ' ' HG3' ' A' ' 48' ' ' LYS . 38.7 tp -60.78 -45.26 95.05 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.679 1.192 . . . . 0.0 110.494 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.63 -37.66 18.82 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.334 1.054 . . . . 0.0 113.509 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -82.48 -28.84 30.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.64 0.376 . . . . 0.0 110.908 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 37' ' ' LEU . 94.3 mt -60.55 -32.36 71.43 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 122.458 0.303 . . . . 0.0 110.219 174.314 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 37' ' ' LEU . 27.8 t -56.59 -56.21 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 123.945 0.898 . . . . 0.0 111.789 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -64.22 -47.08 81.08 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.591 0.557 . . . . 0.0 110.961 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.74 -48.11 82.17 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.453 0.701 . . . . 0.0 112.788 -178.243 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 64.4 m -82.67 -12.29 57.73 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.663 0.385 . . . . 0.0 111.971 -176.885 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 57.23 31.4 20.0 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.779 0.832 . . . . 0.0 111.866 -179.251 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 46' ' ' ALA . . . . . 0.424 ' HB3' HD21 ' A' ' 51' ' ' LEU . . . -125.14 154.61 71.68 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.727 -174.974 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 47' ' ' PRO . . . . . 0.462 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 31.1 Cg_endo -62.22 132.31 38.28 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 121.851 1.701 . . . . 0.0 110.961 175.977 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG3' ' HG ' ' A' ' 37' ' ' LEU . 40.5 ttmt -40.01 -43.99 1.66 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.976 1.31 . . . . 0.0 113.42 174.722 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -58.48 -42.3 87.2 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.182 0.993 . . . . 0.0 112.125 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 50' ' ' GLU . . . . . 0.462 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 10.0 tp10 -64.64 -50.18 68.12 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.698 0.799 . . . . 0.0 109.831 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.424 HD21 ' HB3' ' A' ' 46' ' ' ALA . 51.8 mt -59.42 -54.62 44.59 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.211 1.005 . . . . 0.0 111.503 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 52' ' ' ASN . . . . . 0.51 ' HA ' HD12 ' A' ' 55' ' ' LEU . 58.2 t30 -50.87 -51.2 53.91 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.282 1.833 . . . . 0.0 112.072 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.6 -43.55 98.52 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 123.729 0.643 . . . . 0.0 111.332 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.475 HG21 HD12 ' A' ' 20' ' ' LEU . 83.1 t -65.54 -35.61 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 52' ' ' ASN . 30.9 mt -56.94 -37.54 71.66 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.105 0.962 . . . . 0.0 112.82 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -70.03 -33.43 71.97 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.766 0.712 . . . . 0.0 111.085 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -70.72 -48.25 55.57 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.916 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.739 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 74.9 mtm -64.4 -29.11 70.18 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.857 0.863 . . . . 0.0 111.679 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -63.45 -40.98 98.6 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.053 0.541 . . . . 0.0 110.562 175.333 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -71.46 -25.3 62.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.283 0.633 . . . . 0.0 111.135 176.165 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -85.0 -2.53 58.07 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.283 0.633 . . . . 0.0 111.647 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 66.58 17.1 10.57 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.922 1.289 . . . . 0.0 112.469 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.552 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 96.6 mttt -73.2 -38.61 66.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.043 0.937 . . . . 0.0 110.99 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.438 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 18.6 m -127.1 164.41 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.451 0.7 . . . . 0.0 110.14 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.5 m -144.91 151.66 39.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.0 tp -96.03 101.61 13.29 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.6 p -84.69 -41.78 15.93 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.544 0.738 . . . . 0.0 111.557 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.435 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 49.1 m -134.93 167.77 21.12 Favored Pre-proline 0 N--CA 1.481 1.124 0 C-N-CA 123.751 0.82 . . . . 0.0 109.64 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.98 110.78 0.41 Allowed 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 122.976 2.451 . . . . 0.0 112.867 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.8 33.73 17.6 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.982 1.313 . . . . 0.0 111.56 -178.082 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.435 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 51.0 m -129.67 121.76 27.62 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -118.45 142.47 47.53 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.275 1.03 . . . . 0.0 108.315 -174.12 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 33.7 t -130.4 165.74 21.94 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.647 HD11 ' HB ' ' A' ' 77' ' ' THR . 30.2 tp -74.61 102.53 4.6 Favored 'General case' 0 C--O 1.24 0.584 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.438 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . -74.47 -36.9 48.24 Favored Glycine 0 C--N 1.34 0.794 0 O-C-N 123.896 0.748 . . . . 0.0 111.524 -178.313 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 76' ' ' GLY . . . . . 0.443 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 168.16 98.51 0.12 Allowed Glycine 0 C--N 1.339 0.74 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 176.565 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.647 ' HB ' HD11 ' A' ' 74' ' ' LEU . 6.8 t -73.9 90.9 1.95 Allowed 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 122.075 0.94 . . . . 0.0 109.666 176.651 . . . . . . . . 2 2 . 1 . 017 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -71.12 165.08 51.28 Favored Pre-proline 0 CA--C 1.551 1.0 0 CA-C-N 115.122 -0.944 . . . . 0.0 109.913 176.702 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -37.73 107.37 0.05 OUTLIER 'Trans proline' 0 C--N 1.388 2.607 0 C-N-CA 123.657 2.905 . . . . 0.0 113.985 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 . . . . . 0 C--O 1.248 1.015 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.972 -173.458 . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.4 ptp . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 111.218 0.081 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 018 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.31 164.53 30.6 Favored Glycine 0 C--N 1.36 1.884 0 O-C-N 123.297 0.373 . . . . 0.0 112.41 -175.682 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -70.93 -32.95 70.02 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 170.041 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.1 m-70 -77.72 109.95 12.16 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 166.625 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -72.27 -43.52 64.15 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.959 0.409 . . . . 0.0 110.246 -177.886 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -77.06 137.98 39.28 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.908 170.638 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -92.72 42.64 1.11 Allowed 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -172.502 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -70.77 -30.91 67.53 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.191 0.52 . . . . 0.0 109.967 171.358 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 p -62.14 91.98 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.213 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -68.67 128.02 35.15 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.16 178.398 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 19.1 ptp 38.42 65.29 0.63 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 125.253 1.421 . . . . 0.0 111.459 -173.168 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.92 87.41 0.01 OUTLIER 'General case' 0 C--N 1.351 0.65 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.681 -171.854 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -67.67 125.54 91.4 Favored Pre-proline 0 CA--C 1.532 0.273 0 C-N-CA 124.27 1.028 . . . . 0.0 109.632 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -56.79 148.64 64.94 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 122.4 2.067 . . . . 0.0 110.845 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -132.71 108.52 0.77 Allowed Glycine 0 C--N 1.338 0.64 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -60.91 -42.3 97.78 Favored 'General case' 0 C--O 1.211 -0.948 0 C-N-CA 123.261 0.625 . . . . 0.0 112.421 -167.67 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.15 -57.72 11.33 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.916 0.486 . . . . 0.0 111.027 -176.488 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.9 -44.2 89.55 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 124.045 0.841 . . . . 0.0 114.762 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -70.67 -39.6 73.48 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.929 0.864 . . . . 0.0 110.972 -175.373 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.445 ' O ' HG13 ' A' ' 24' ' ' ILE . 2.4 tm? -64.98 -40.29 94.75 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.348 0.659 . . . . 0.0 110.1 174.788 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -58.66 -47.76 83.37 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.295 1.038 . . . . 0.0 111.395 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -36.88 82.8 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.039 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.427 ' O ' HG23 ' A' ' 27' ' ' VAL . 16.4 tpt180 -67.41 -41.63 84.56 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.083 0.553 . . . . 0.0 111.011 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.474 HG21 HD21 ' A' ' 55' ' ' LEU . 79.4 mt -60.28 -52.93 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 122.836 0.454 . . . . 0.0 110.432 176.369 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.18 -32.68 72.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.503 0.721 . . . . 0.0 111.09 -178.458 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -63.55 -52.13 62.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.354 1.061 . . . . 0.0 109.926 176.993 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 23' ' ' ARG . 76.1 t -58.2 -41.86 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.966 0.906 . . . . 0.0 110.591 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.479 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 97.5 mt -69.88 -36.0 75.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.302 0.641 . . . . 0.0 111.695 -177.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -70.44 -45.04 66.61 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.359 0.663 . . . . 0.0 111.861 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -71.81 -33.42 68.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.948 0.499 . . . . 0.0 111.326 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.79 68.98 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 168.822 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.84 26.53 67.2 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.643 -175.689 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.1 t -152.53 150.6 25.3 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.262 1.025 . . . . 0.0 109.028 -171.307 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.19 125.11 15.49 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.675 2.25 . . . . 0.0 113.32 173.185 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.94 132.8 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.143 0.977 . . . . 0.0 108.521 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 54.7 mtpt -64.35 151.7 43.24 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.492 0.717 . . . . 0.0 111.19 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.416 ' O ' HG23 ' A' ' 41' ' ' VAL . 51.9 tp -62.4 -50.51 71.26 Favored 'General case' 0 C--N 1.356 0.855 0 O-C-N 123.424 0.452 . . . . 0.0 109.852 176.382 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.03 -37.95 10.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.99 0.916 . . . . 0.0 112.848 170.919 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 39' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 61.6 tt0 -78.31 -34.66 48.57 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.253 0.621 . . . . 0.0 110.619 -179.475 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 66.9 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.601 0.761 . . . . 0.0 110.815 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 37' ' ' LEU . 35.8 t -55.49 -50.88 63.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.37 0.668 . . . . 0.0 111.706 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -76.26 -43.62 41.05 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.986 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 43' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -59.59 -56.51 20.96 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.274 0.488 . . . . 0.0 112.039 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 62.7 m -72.74 -8.39 55.16 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.827 0.451 . . . . 0.0 111.632 -177.807 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 61.9 22.87 13.37 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.017 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.84 149.01 58.35 Favored Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.92 -164.417 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.47 133.14 29.2 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.508 2.139 . . . . 0.0 111.761 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -42.15 -36.14 1.11 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.734 1.613 . . . . 0.0 112.934 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.9 ttm105 -54.6 -56.62 17.09 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.355 1.062 . . . . 0.0 112.21 176.222 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -44.75 79.53 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.873 -176.787 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.7 mt -55.37 -59.71 4.43 Favored 'General case' 0 C--O 1.212 -0.881 0 O-C-N 124.082 0.864 . . . . 0.0 111.093 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -48.4 -56.12 9.01 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.278 1.431 . . . . 0.0 112.089 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.33 -52.61 64.63 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.779 0.832 . . . . 0.0 112.101 -177.441 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.544 HG12 ' SD ' ' A' ' 58' ' ' MET . 97.4 t -67.05 -38.0 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 122.821 0.448 . . . . 0.0 110.204 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.474 HD21 HG21 ' A' ' 24' ' ' ILE . 17.4 mt -54.06 -40.38 67.1 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.685 1.194 . . . . 0.0 114.137 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -71.76 -24.32 61.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 119.436 1.016 . . . . 0.0 111.365 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -73.61 -48.82 29.76 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.544 ' SD ' HG12 ' A' ' 54' ' ' VAL . 66.0 mtp -60.68 -37.74 82.64 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.603 1.161 . . . . 0.0 111.476 179.3 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -58.51 -45.97 87.69 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.424 1.09 . . . . 0.0 110.599 175.397 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 60' ' ' LYS . . . . . 0.43 ' NZ ' ' HB2' ' A' ' 60' ' ' LYS . 4.3 ttmp? -72.77 -26.45 61.54 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.096 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -85.52 -2.17 57.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.831 0.852 . . . . 0.0 111.265 174.551 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 69.95 12.17 7.81 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.978 1.311 . . . . 0.0 112.306 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 94.4 mttt -70.03 -37.13 75.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.726 0.81 . . . . 0.0 110.792 175.272 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 22.2 m -131.25 175.77 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.734 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.3 t -144.13 158.13 43.9 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 30.5 tp -109.56 113.16 25.72 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 175.764 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.6 p -100.47 -31.95 11.04 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.572 0.749 . . . . 0.0 111.283 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.684 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 39.2 t -139.23 148.37 56.82 Favored Pre-proline 0 CA--C 1.552 1.035 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -26.0 -72.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.39 2.739 1 C-N-CA 125.407 4.071 . . . . 0.0 116.721 -172.39 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.84 39.34 2.4 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.345 0.658 . . . . 0.0 111.008 177.013 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.684 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 86.2 m -131.27 123.02 27.48 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.801 0.84 . . . . 0.0 109.239 176.535 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -104.51 160.34 15.01 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.622 -173.133 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 51.8 t -138.63 156.17 47.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 74' ' ' LEU . . . . . 0.504 HD21 ' HB ' ' A' ' 77' ' ' THR . 35.7 tp -76.21 131.03 39.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.393 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -108.35 -55.94 0.58 Allowed Glycine 0 C--N 1.343 0.924 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 178.377 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -138.89 102.88 0.37 Allowed Glycine 0 C--N 1.335 0.49 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 77' ' ' THR . . . . . 0.504 ' HB ' HD21 ' A' ' 74' ' ' LEU . 11.4 t -100.96 172.6 6.93 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.553 0.741 . . . . 0.0 110.628 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -158.16 58.4 1.38 Allowed Pre-proline 0 CA--C 1.561 1.393 0 C-N-CA 123.583 0.753 . . . . 0.0 110.186 179.219 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -88.56 -156.84 0.06 OUTLIER 'Trans proline' 0 C--N 1.378 2.104 0 C-N-CA 123.0 2.466 . . . . 0.0 112.331 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 . . . . . 0 C--O 1.249 1.077 0 C-N-CA 123.479 0.712 . . . . 0.0 110.072 -179.259 . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.32 0.105 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 019 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.78 -5.19 37.27 Favored Glycine 0 C--N 1.348 1.248 0 N-CA-C 116.14 1.216 . . . . 0.0 116.14 -171.378 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -63.47 -33.31 75.29 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 117.922 0.861 . . . . 0.0 110.532 173.399 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -81.21 76.71 8.14 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.967 177.7 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.0 m170 -149.59 156.19 41.53 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.82 1.248 . . . . 0.0 108.667 176.687 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -79.27 87.27 4.97 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-O 121.598 0.713 . . . . 0.0 109.923 177.469 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -81.3 -41.53 21.98 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -122.66 107.84 12.41 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.084 0.954 . . . . 0.0 108.44 177.594 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 9' ' ' SER . . . . . 0.403 ' H ' ' H ' ' A' ' 10' ' ' HIS . 30.9 t -174.55 -8.74 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.509 0.724 . . . . 0.0 111.758 -177.591 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 10' ' ' HIS . . . . . 0.403 ' H ' ' H ' ' A' ' 9' ' ' SER . 58.3 t-80 64.73 78.29 0.29 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.824 1.25 . . . . 0.0 111.066 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -62.58 115.08 3.96 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.381 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -156.36 35.86 0.33 Allowed 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 121.792 0.806 . . . . 0.0 109.412 -175.339 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -151.39 171.35 6.6 Favored Pre-proline 0 CA--C 1.549 0.929 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.349 -172.519 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -65.34 -130.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.382 2.325 0 C-N-CA 122.438 2.092 . . . . 0.0 112.61 169.731 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.47 -58.27 3.05 Favored Glycine 0 C--N 1.348 1.209 0 O-C-N 121.353 -0.842 . . . . 0.0 114.375 -175.233 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -62.25 -44.57 96.25 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -170.424 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -65.47 -44.11 88.19 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 123.194 0.308 . . . . 0.0 110.517 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.05 -32.06 81.31 Favored Glycine 0 C--N 1.342 0.865 0 O-C-N 123.5 0.5 . . . . 0.0 113.369 174.891 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -65.58 -45.28 83.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.439 0.638 . . . . 0.0 109.403 176.099 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.599 HD12 HG21 ' A' ' 54' ' ' VAL . 2.3 tm? -67.4 -37.63 83.4 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 113.943 -1.481 . . . . 0.0 111.404 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -65.18 -43.19 92.48 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.015 0.926 . . . . 0.0 110.709 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -66.9 -34.42 77.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.753 175.458 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.524 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -59.48 -52.7 64.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.234 0.614 . . . . 0.0 110.791 174.185 . . . . . . . . 3 3 . 1 . 019 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.475 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.3 mt -55.57 -48.81 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 O-C-N 124.251 0.969 . . . . 0.0 110.449 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.571 HD21 ' HB3' ' A' ' 63' ' ' LYS . 89.0 mt -62.56 -37.14 84.99 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.217 0.607 . . . . 0.0 111.568 -178.838 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -66.74 -47.92 70.77 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.743 0.652 . . . . 0.0 110.465 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 23' ' ' ARG . 85.2 t -56.79 -40.49 71.1 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.153 0.981 . . . . 0.0 110.885 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 93.4 mt -69.47 -38.82 77.88 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.069 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.2 m -69.37 -45.97 68.07 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.546 0.738 . . . . 0.0 111.677 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -68.88 -34.83 76.08 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.437 0.695 . . . . 0.0 110.613 -176.796 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.76 83.23 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.7 171.161 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.7 28.89 68.76 Favored Glycine 0 C--N 1.352 1.429 0 O-C-N 123.946 0.779 . . . . 0.0 111.853 -171.024 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.5 t -162.19 147.51 10.13 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.41 1.084 . . . . 0.0 109.057 -165.754 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 34' ' ' PRO . . . . . 0.401 ' HG3' ' HB2' ' A' ' 73' ' ' CYS . 74.3 Cg_exo -51.86 114.77 1.75 Allowed 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 123.163 2.575 . . . . 0.0 113.757 174.79 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 35' ' ' VAL . . . . . 0.403 HG21 HG12 ' A' ' 27' ' ' VAL . 90.1 t -96.37 146.75 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.056 0.942 . . . . 0.0 109.691 179.214 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -82.01 152.56 26.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.505 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.45 ' HA ' HD12 ' A' ' 40' ' ' LEU . 39.1 tp -57.61 -49.46 76.35 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.517 1.127 . . . . 0.0 111.053 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.66 -32.58 42.9 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 30.2 tt0 -83.88 -27.48 28.62 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.959 0.409 . . . . 0.0 110.199 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 40' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 37' ' ' LEU . 91.6 mt -65.64 -28.65 69.26 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.581 0.753 . . . . 0.0 110.504 174.061 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.582 ' HA ' HD11 ' A' ' 51' ' ' LEU . 91.8 t -56.21 -52.3 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.004 0.522 . . . . 0.0 111.926 -178.565 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -71.5 -50.73 28.65 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 123.561 0.538 . . . . 0.0 111.166 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.9 -49.38 46.44 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 123.492 0.717 . . . . 0.0 111.391 -172.777 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 44' ' ' CYS . . . . . 0.489 ' HA ' ' HB3' ' A' ' 23' ' ' ARG . 54.6 m -76.46 -11.7 59.92 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.511 0.324 . . . . 0.0 111.276 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 62.85 51.3 3.01 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.266 1.026 . . . . 0.0 111.644 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -149.74 152.06 33.97 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 123.007 0.523 . . . . 0.0 110.652 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.83 145.92 94.85 Favored 'Trans proline' 0 C--N 1.366 1.5 0 C-N-CA 122.496 2.131 . . . . 0.0 111.727 173.127 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -39.44 -56.58 1.58 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.87 1.268 . . . . 0.0 113.735 177.6 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -58.11 -36.37 72.8 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.611 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.94 -48.3 74.57 Favored 'General case' 0 C--O 1.245 0.853 0 O-C-N 123.54 0.525 . . . . 0.0 109.978 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.582 HD11 ' HA ' ' A' ' 41' ' ' VAL . 57.3 mt -55.35 -53.25 58.49 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 124.521 1.138 . . . . 0.0 111.52 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -49.76 -50.1 45.82 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 124.383 1.052 . . . . 0.0 112.285 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -56.79 -46.52 81.5 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 124.313 1.008 . . . . 0.0 111.067 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.599 HG21 HD12 ' A' ' 20' ' ' LEU . 54.0 t -70.32 -43.16 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.877 0.471 . . . . 0.0 110.835 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 55' ' ' LEU . . . . . 0.407 HD13 ' NE1' ' A' ' 72' ' ' TRP . 60.8 mt -51.9 -49.67 62.57 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.03 1.332 . . . . 0.0 114.078 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -71.69 -26.31 62.46 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 118.08 0.4 . . . . 0.0 110.927 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 57' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.8 tmt_? -68.43 -52.28 34.52 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.479 0.711 . . . . 0.0 109.431 174.462 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.504 ' SD ' HG12 ' A' ' 54' ' ' VAL . 83.3 mtp -61.11 -29.25 69.65 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.695 1.198 . . . . 0.0 111.498 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -63.78 -41.96 97.86 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.944 0.497 . . . . 0.0 110.575 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -71.49 -28.55 64.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 123.83 0.706 . . . . 0.0 110.758 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 61' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.01 -2.65 45.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.125 0.57 . . . . 0.0 110.921 173.201 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 74.4 mt 63.88 16.11 9.6 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.036 1.334 . . . . 0.0 112.115 178.62 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.571 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.9 mttt -77.06 -32.46 56.85 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.257 1.023 . . . . 0.0 110.637 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.405 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 22.0 m -129.51 164.18 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 26.7 t -137.11 148.25 46.56 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.53 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.0 tp -100.57 106.58 18.1 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 11.6 p -88.18 -43.97 11.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.902 0.881 . . . . 0.0 111.063 -176.869 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 34.3 t -140.73 153.71 68.14 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -177.135 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.02 112.75 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.528 0 C-N-CA 123.235 2.623 . . . . 0.0 114.608 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 68.73 20.41 8.17 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.856 1.262 . . . . 0.0 112.075 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 6.2 m -126.04 115.48 19.93 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.713 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 72' ' ' TRP . . . . . 0.407 ' NE1' HD13 ' A' ' 55' ' ' LEU . 82.5 m95 -115.99 142.98 46.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.712 0.805 . . . . 0.0 109.797 -167.704 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 73' ' ' CYS . . . . . 0.401 ' HB2' ' HG3' ' A' ' 34' ' ' PRO . 53.4 t -113.94 161.47 17.6 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 123.223 0.609 . . . . 0.0 110.213 177.712 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.58 102.38 0.9 Allowed 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.511 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.405 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . -79.08 -35.2 31.17 Favored Glycine 0 C--N 1.343 0.924 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.647 -178.589 . . . . . . . . 2 2 . 1 . 019 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.74 46.95 3.51 Favored Glycine 0 C--N 1.347 1.167 0 N-CA-C 111.561 -0.615 . . . . 0.0 111.561 176.307 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.5 t -79.99 89.2 5.33 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.926 0.89 . . . . 0.0 109.93 -179.407 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 50.37 69.52 2.57 Favored Pre-proline 0 N--CA 1.478 0.948 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.151 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.88 -52.44 8.0 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 123.576 2.851 . . . . 0.0 112.608 -174.476 . . . . . . . . 1 1 . 1 . 019 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 C--O 1.252 1.19 0 O-C-N 124.294 0.996 . . . . 0.0 108.812 177.872 . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.8 tpt . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 . . . . . . . . . 0 0 . 1 . 020 nuclear build full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.53 175.36 53.21 Favored Glycine 0 CA--C 1.528 0.891 0 O-C-N 123.46 0.475 . . . . 0.0 112.763 177.091 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.3 m170 63.54 -84.62 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.789 1.235 . . . . 0.0 110.931 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -90.47 69.91 6.9 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.982 0.896 . . . . 0.0 109.759 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.9 p80 -85.2 54.75 3.21 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.424 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -68.99 -35.39 76.65 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.464 1.106 . . . . 0.0 111.787 -170.373 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 p-80 49.53 -66.46 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 127.093 2.157 . . . . 0.0 114.929 -176.177 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 80.9 t60 74.29 -16.5 0.53 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 125.38 1.472 . . . . 0.0 114.439 167.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 m -88.39 72.09 8.95 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 118.499 0.59 . . . . 0.0 110.091 -177.013 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -86.94 74.02 9.82 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.556 0.743 . . . . 0.0 109.975 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 23.6 mmt 70.51 -68.33 0.21 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 126.071 1.748 . . . . 0.0 111.234 -177.923 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.57 -172.31 2.13 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.776 1.23 . . . . 0.0 109.443 178.342 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 72.71 141.35 0.08 OUTLIER Pre-proline 0 N--CA 1.487 1.398 0 C-N-CA 124.996 1.318 . . . . 0.0 113.45 168.961 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -89.21 16.29 1.83 Allowed 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 123.397 2.731 . . . . 0.0 113.348 175.487 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -47.47 -27.87 4.47 Favored Glycine 0 C--N 1.353 1.514 0 N-CA-C 115.411 0.925 . . . . 0.0 115.411 175.268 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.0 ttm-85 -61.65 -33.59 74.22 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 123.733 0.813 . . . . 0.0 111.643 177.739 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -55.43 -44.65 76.48 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.674 0.39 . . . . 0.0 110.852 176.659 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.62 -32.82 61.29 Favored Glycine 0 C--N 1.347 1.174 0 O-C-N 124.262 0.976 . . . . 0.0 114.275 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -67.47 -51.97 44.91 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.818 0.447 . . . . 0.0 110.555 176.155 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 20' ' ' LEU . . . . . 0.575 HD11 HD23 ' A' ' 51' ' ' LEU . 2.7 tm? -63.44 -37.18 86.29 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.996 1.319 . . . . 0.0 110.652 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 21' ' ' GLU . . . . . 0.749 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 29.3 tt0 -56.56 -48.72 76.73 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.537 1.135 . . . . 0.0 110.305 171.235 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -62.84 -38.88 92.54 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.152 -177.338 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 23' ' ' ARG . . . . . 0.504 ' O ' HG23 ' A' ' 27' ' ' VAL . 26.8 mmt180 -64.96 -51.91 59.18 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 122.764 0.425 . . . . 0.0 111.477 178.661 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 24' ' ' ILE . . . . . 0.47 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 61.6 mt -57.35 -47.85 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 O-C-N 123.865 0.728 . . . . 0.0 110.514 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 25' ' ' LEU . . . . . 0.458 HD21 ' HB3' ' A' ' 63' ' ' LYS . 94.3 mt -65.55 -32.95 74.81 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.189 0.596 . . . . 0.0 111.422 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -69.94 -43.02 72.44 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.497 0.498 . . . . 0.0 110.102 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 27' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 23' ' ' ARG . 87.8 t -56.57 -43.5 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.684 0.794 . . . . 0.0 110.748 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 28' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 79.9 mt -66.56 -42.82 86.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.293 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.5 m -72.85 -38.17 67.17 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.187 0.995 . . . . 0.0 111.91 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.51 -42.65 74.43 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.751 0.42 . . . . 0.0 110.644 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.99 -36.94 83.28 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.722 0.639 . . . . 0.0 110.862 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 59.11 34.12 77.93 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 124.155 0.909 . . . . 0.0 112.508 -174.81 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.9 t -164.29 151.56 10.25 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.459 1.104 . . . . 0.0 108.615 -166.949 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.59 118.87 5.56 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.366 2.711 . . . . 0.0 112.607 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 46.6 t -102.96 127.58 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -68.95 150.49 47.66 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.421 0.689 . . . . 0.0 110.709 -178.253 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 37' ' ' LEU . . . . . 0.531 HD21 ' HG3' ' A' ' 48' ' ' LYS . 57.6 tp -58.58 -46.78 86.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.076 0.95 . . . . 0.0 111.373 -179.431 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.86 -35.93 46.67 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.937 0.895 . . . . 0.0 113.269 171.328 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.33 -34.13 48.78 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.9 mt -64.18 -33.42 75.74 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.954 0.902 . . . . 0.0 110.728 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 41' ' ' VAL . . . . . 0.582 ' HA ' HD11 ' A' ' 51' ' ' LEU . 83.4 t -58.91 -47.74 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 123.318 0.647 . . . . 0.0 110.259 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -67.4 -54.04 23.94 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.28 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -70.29 -48.95 54.36 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.803 0.841 . . . . 0.0 112.867 -171.703 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 44.3 m -77.31 -16.06 59.12 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 62.74 56.28 1.96 Allowed 'General case' 0 C--N 1.364 1.215 0 C-N-CA 124.295 1.038 . . . . 0.0 110.574 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.43 151.32 36.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.105 -173.626 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -59.54 137.61 78.74 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.834 2.356 . . . . 0.0 111.969 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HG3' HD21 ' A' ' 37' ' ' LEU . 22.7 ttmm -35.1 -48.35 0.42 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.595 1.558 . . . . 0.0 112.945 169.741 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -61.33 -48.34 81.8 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 111.82 -178.912 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.9 -46.72 86.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.287 0.635 . . . . 0.0 110.164 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 51' ' ' LEU . . . . . 0.582 HD11 ' HA ' ' A' ' 41' ' ' VAL . 83.6 mt -52.79 -53.71 44.43 Favored 'General case' 0 C--O 1.206 -1.204 0 O-C-N 124.353 1.033 . . . . 0.0 110.735 174.434 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 81.5 m-20 -59.21 -46.37 88.64 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.582 1.177 . . . . 0.0 112.766 -175.58 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.61 -43.21 72.0 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.428 0.455 . . . . 0.0 111.254 176.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 54' ' ' VAL . . . . . 0.458 HG21 HD12 ' A' ' 20' ' ' LEU . 50.7 t -72.79 -39.35 59.45 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.987 176.821 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.2 -53.88 53.24 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.781 1.232 . . . . 0.0 114.232 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -69.84 -26.31 64.16 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 119.557 1.071 . . . . 0.0 110.49 -176.733 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -65.03 -53.26 48.81 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.037 0.935 . . . . 0.0 109.387 171.722 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 58' ' ' MET . . . . . 0.749 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 73.3 mtm -64.04 -26.92 68.78 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.51 1.124 . . . . 0.0 111.906 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -66.86 -41.1 87.86 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.564 0.746 . . . . 0.0 110.347 176.768 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -63.45 -40.33 96.85 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.477 0.711 . . . . 0.0 109.939 172.216 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.77 0.65 22.9 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.852 0.861 . . . . 0.0 111.944 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.8 mt 67.96 10.45 7.81 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 125.881 1.672 . . . . 0.0 113.298 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 63' ' ' LYS . . . . . 0.566 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 55.0 mttm -69.24 -44.12 72.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.479 1.112 . . . . 0.0 110.533 177.732 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 64' ' ' VAL . . . . . 0.436 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 26.8 m -123.32 164.41 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.657 0.783 . . . . 0.0 109.778 -178.472 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.2 t -147.03 157.64 43.68 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.723 0.809 . . . . 0.0 109.034 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 66' ' ' LEU . . . . . 0.403 HD12 ' O ' ' A' ' 71' ' ' THR . 30.8 tp -101.5 106.89 18.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -178.187 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.2 p -86.08 -40.39 15.77 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.237 0.615 . . . . 0.0 110.748 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 68' ' ' SER . . . . . 0.437 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 16.0 p -142.21 160.65 54.15 Favored Pre-proline 0 CA--C 1.558 1.285 0 CA-C-O 117.753 -1.118 . . . . 0.0 108.357 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 37.2 Cg_exo -22.97 -70.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.393 2.892 1 C-N-CA 126.099 4.533 . . . . 0.0 117.79 -168.426 . . . . . . . . 3 3 . 1 . 020 nuclear build full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.34 42.08 2.49 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.637 0.775 . . . . 0.0 110.506 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 71' ' ' THR . . . . . 0.403 ' O ' HD12 ' A' ' 66' ' ' LEU . 59.3 m -130.16 125.95 36.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.677 0.791 . . . . 0.0 109.92 -177.747 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -115.5 136.06 53.46 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.652 0.781 . . . . 0.0 109.259 -174.198 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 32.3 t -118.31 171.52 8.08 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.0 tp -68.83 104.75 2.13 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 173.079 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 75' ' ' GLY . . . . . 0.436 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . -69.01 -52.05 25.59 Favored Glycine 0 C--N 1.348 1.215 0 O-C-N 123.946 0.779 . . . . 0.0 111.379 -178.212 . . . . . . . . 2 2 . 1 . 020 nuclear build full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.65 -155.42 23.07 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 114.854 -0.673 . . . . 0.0 112.128 173.954 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.3 t -169.1 165.98 11.01 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 123.205 0.602 . . . . 0.0 110.348 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -131.71 128.05 21.59 Favored Pre-proline 0 N--CA 1.471 0.608 0 C-N-CA 123.835 0.854 . . . . 0.0 108.875 176.207 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -70.4 79.3 1.15 Allowed 'Trans proline' 0 C--N 1.375 1.936 0 C-N-CA 123.136 2.557 . . . . 0.0 111.913 176.368 . . . . . . . . 1 1 . 1 . 020 nuclear build full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.944 0 N-CA-C 106.503 -1.665 . . . . 0.0 106.503 -179.26 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 . . . . . 0 N--CA 1.477 0.906 0 CA-C-O 119.475 -0.298 . . . . 0.0 111.211 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -62.93 -44.44 97.4 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-O 119.446 -0.641 . . . . 0.0 112.855 171.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -66.87 -42.9 84.85 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.51 0.671 . . . . 0.0 109.745 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.457 HD11 HD23 ' A' ' 51' ' ' LEU . 2.0 tm? -62.42 -41.41 98.68 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.609 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -64.42 -42.82 95.84 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.673 0.789 . . . . 0.0 110.33 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 99.3 mt-30 -62.31 -36.25 81.57 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.06 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.532 ' O ' HG23 ' A' ' 27' ' ' VAL . 34.9 mmm-85 -64.84 -50.66 65.77 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 123.702 0.626 . . . . 0.0 110.852 175.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 80.2 mt -56.63 -50.39 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 124.141 0.9 . . . . 0.0 109.864 -176.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.574 HD21 ' HB3' ' A' ' 63' ' ' LYS . 96.1 mt -61.69 -37.84 85.62 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.594 0.758 . . . . 0.0 111.274 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -69.58 -44.47 70.75 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.016 0.926 . . . . 0.0 110.517 -176.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 23' ' ' ARG . 94.4 t -60.1 -43.12 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.95 0.9 . . . . 0.0 110.241 176.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 80.6 mt -64.48 -34.96 79.42 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.853 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.6 m -74.52 -43.15 57.25 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 123.644 0.778 . . . . 0.0 111.283 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -62.67 -41.57 99.15 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.451 0.7 . . . . 0.0 110.361 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -41.91 92.6 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.976 0.798 . . . . 0.0 110.417 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 63.62 27.61 71.24 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.464 -170.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.9 m -159.16 161.74 27.28 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.016 1.326 . . . . 0.0 109.611 -166.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -53.84 125.85 20.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 122.802 2.335 . . . . 0.0 113.473 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.476 HG21 HG12 ' A' ' 27' ' ' VAL . 76.8 t -107.37 130.45 59.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.18 0.992 . . . . 0.0 108.392 174.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.32 151.59 47.2 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.639 0.776 . . . . 0.0 110.499 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.484 HD21 HD21 ' A' ' 52' ' ' ASN . 54.5 tp -63.04 -49.01 76.24 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.969 0.907 . . . . 0.0 110.425 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -50.09 -37.6 34.59 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.822 0.849 . . . . 0.0 112.333 170.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.424 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 46.3 tt0 -73.95 -36.38 64.62 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.88 -31.51 72.56 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.272 0.629 . . . . 0.0 110.393 178.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.518 ' HA ' HD11 ' A' ' 51' ' ' LEU . 45.4 t -57.85 -54.03 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 O-C-N 123.573 0.546 . . . . 0.0 110.717 174.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HE3' ' HG3' ' A' ' 39' ' ' GLN . 20.6 pttp -75.13 -39.21 60.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.499 -173.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -65.39 -58.21 6.44 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.42 0.688 . . . . 0.0 111.87 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 37.6 m -80.97 -4.36 54.79 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.817 0.447 . . . . 0.0 111.252 -173.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 62.08 31.25 17.91 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.12 1.368 . . . . 0.0 111.597 171.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -128.47 150.06 73.41 Favored Pre-proline 0 N--CA 1.476 0.873 0 C-N-CA 123.52 0.728 . . . . 0.0 110.344 -175.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.2 142.07 71.99 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.458 2.106 . . . . 0.0 111.757 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -43.46 -41.3 4.24 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.769 1.228 . . . . 0.0 112.051 172.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -54.09 -51.69 63.36 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.362 1.065 . . . . 0.0 111.625 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -66.49 -44.9 81.36 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.568 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.518 HD11 ' HA ' ' A' ' 41' ' ' VAL . 98.5 mt -54.75 -51.17 66.52 Favored 'General case' 0 C--O 1.212 -0.879 0 O-C-N 124.43 1.081 . . . . 0.0 111.253 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.484 HD21 HD21 ' A' ' 37' ' ' LEU . 14.8 m120 -48.74 -56.75 7.73 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.087 0.955 . . . . 0.0 112.194 -179.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -58.93 -41.89 88.46 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 123.997 0.81 . . . . 0.0 112.115 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.506 HG13 HH21 ' A' ' 57' ' ' ARG . 86.1 t -68.95 -48.31 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 122.987 0.515 . . . . 0.0 110.259 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -55.59 -38.29 69.2 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.563 1.545 . . . . 0.0 114.178 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -70.41 -30.78 67.75 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 118.767 0.712 . . . . 0.0 110.792 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.506 HH21 HG13 ' A' ' 54' ' ' VAL . 46.5 ttp180 -71.42 -44.23 65.26 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.858 0.724 . . . . 0.0 109.348 176.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.461 ' SD ' HG12 ' A' ' 54' ' ' VAL . 80.5 mtp -63.55 -31.98 73.3 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.335 1.054 . . . . 0.0 111.046 176.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.52 -44.92 95.17 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.708 0.803 . . . . 0.0 110.611 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 57' ' ' ARG . 52.7 mttm -63.02 -35.9 81.77 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.623 0.769 . . . . 0.0 110.749 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -85.88 5.25 33.74 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.555 0.742 . . . . 0.0 111.312 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.8 mt 66.36 9.95 6.84 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 125.218 1.407 . . . . 0.0 113.016 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.574 ' HB3' HD21 ' A' ' 25' ' ' LEU . 94.2 mttt -69.11 -35.34 76.32 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.372 1.069 . . . . 0.0 111.094 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.5 m -129.8 158.67 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.613 0.765 . . . . 0.0 109.919 177.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.1 m -132.92 152.85 51.83 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.421 1.089 . . . . 0.0 108.075 172.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.96 112.77 24.58 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.1 p -87.58 -37.72 16.59 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.12 0.568 . . . . 0.0 111.553 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.624 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 9.2 t -140.59 155.09 69.75 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -176.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -26.18 -68.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.391 2.799 0 C-N-CA 125.071 3.847 . . . . 0.0 116.495 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.22 41.35 2.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.186 0.594 . . . . 0.0 110.902 176.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.624 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 26.5 m -129.37 125.71 37.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.641 0.776 . . . . 0.0 108.955 174.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -108.27 163.83 12.85 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.802 0.841 . . . . 0.0 109.219 -175.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.428 ' HA ' HD22 ' A' ' 28' ' ' LEU . 43.9 t -146.3 164.02 33.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 177.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.444 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 35.2 tp -68.35 135.38 51.75 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.415 -0.958 . . . . 0.0 108.415 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.351 1.393 0 O-C-N 124.174 0.922 . . . . 0.0 111.608 179.348 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 . . . . . 0 N--CA 1.475 0.803 0 CA-C-O 119.661 -0.209 . . . . 0.0 111.524 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.42 -52.76 47.97 Favored Glycine 0 C--N 1.346 1.134 0 N-CA-C 114.371 0.508 . . . . 0.0 114.371 171.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -67.27 -36.04 80.76 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.961 0.504 . . . . 0.0 110.155 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.421 ' O ' HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -64.37 -51.88 61.08 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.123 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.29 -47.43 79.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.96 0.904 . . . . 0.0 111.108 -175.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -38.11 85.7 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 124.067 0.854 . . . . 0.0 110.739 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.434 ' O ' HG23 ' A' ' 27' ' ' VAL . 14.1 tpp180 -71.83 -38.51 70.15 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 122.986 0.514 . . . . 0.0 110.857 -178.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 20' ' ' LEU . 82.5 mt -58.76 -51.76 68.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 122.806 0.443 . . . . 0.0 109.934 174.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.409 HD21 ' HB3' ' A' ' 63' ' ' LYS . 98.6 mt -56.1 -43.15 77.82 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 123.672 0.789 . . . . 0.0 110.905 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -61.64 -51.18 69.51 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 124.194 0.934 . . . . 0.0 111.12 -175.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 23' ' ' ARG . 87.7 t -57.82 -41.97 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 124.133 0.896 . . . . 0.0 110.971 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.05 -33.11 71.53 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.252 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.6 m -71.64 -49.43 40.08 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 123.432 0.693 . . . . 0.0 112.12 177.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.51 -36.46 82.64 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.21 0.604 . . . . 0.0 110.268 -176.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.62 -38.35 70.81 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.815 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.52 22.98 64.33 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 124.031 0.832 . . . . 0.0 113.342 -176.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.6 m -152.62 164.88 18.89 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.149 0.98 . . . . 0.0 109.724 -167.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -58.93 117.09 3.76 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 122.364 2.043 . . . . 0.0 112.509 172.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.4 t -111.31 133.2 57.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.625 1.17 . . . . 0.0 108.573 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 59.4 mtpt -68.77 144.58 54.29 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.347 0.659 . . . . 0.0 109.875 177.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.478 HD13 HD11 ' A' ' 55' ' ' LEU . 29.1 tp -58.48 -40.44 82.74 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.721 0.638 . . . . 0.0 110.808 176.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.02 -44.83 2.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.418 1.087 . . . . 0.0 113.16 167.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -81.66 -32.61 31.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.346 0.258 . . . . 0.0 110.536 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.3 mt -58.62 -33.52 70.13 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.666 0.387 . . . . 0.0 110.194 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 37' ' ' LEU . 99.0 t -52.8 -58.8 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.78 0.832 . . . . 0.0 112.285 173.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -70.5 -40.96 73.27 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -69.33 -43.58 73.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 82.0 m -77.77 -15.47 59.08 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 61.28 26.15 16.03 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.786 0.835 . . . . 0.0 110.296 -173.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.91 143.75 31.4 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 124.124 0.969 . . . . 0.0 110.081 -171.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.66 138.32 41.23 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.583 2.189 . . . . 0.0 111.615 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -47.99 -30.3 4.19 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.218 1.407 . . . . 0.0 112.721 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 mtm180 -56.45 -56.69 18.01 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.143 0.977 . . . . 0.0 111.136 174.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.417 ' HA ' HE21 ' A' ' 53' ' ' GLN . 3.5 mp0 -66.23 -43.01 87.82 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.21 -177.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.7 mt -54.74 -52.9 61.07 Favored 'General case' 0 C--O 1.209 -1.048 0 O-C-N 124.448 1.093 . . . . 0.0 110.098 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -47.53 -58.9 3.67 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.283 1.033 . . . . 0.0 112.08 176.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.417 HE21 ' HA ' ' A' ' 50' ' ' GLU . 46.8 mt-30 -53.51 -50.88 64.48 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.226 1.01 . . . . 0.0 112.339 -177.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.29 -43.68 84.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 C-N-CA 123.147 0.579 . . . . 0.0 111.462 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.478 HD11 HD13 ' A' ' 37' ' ' LEU . 27.8 mt -48.19 -48.5 34.66 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.992 1.317 . . . . 0.0 114.265 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -72.48 -25.62 61.49 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.392 0.996 . . . . 0.0 111.86 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -70.31 -55.34 9.42 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.459 ' HB2' ' HB2' ' A' ' 63' ' ' LYS . 18.0 ptm -67.99 -23.85 65.07 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.922 -178.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.2 tttm -69.15 -43.1 74.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.608 0.763 . . . . 0.0 110.72 171.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.407 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -59.19 -37.88 78.48 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.98 0.912 . . . . 0.0 110.577 175.298 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -86.21 -0.49 55.87 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 115.056 -0.975 . . . . 0.0 112.038 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.3 mt 60.8 24.72 14.62 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.068 1.347 . . . . 0.0 112.688 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 58' ' ' MET . 55.1 mttm -67.5 -32.13 72.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.505 1.122 . . . . 0.0 109.569 168.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.458 HG22 ' HG3' ' A' ' 58' ' ' MET . 28.1 m -133.37 160.79 42.17 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.558 171.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.1 m -129.85 156.46 44.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 171.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.4 tp -103.07 112.4 25.22 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.9 p -94.9 -43.82 8.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.696 0.399 . . . . 0.0 111.23 -174.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.694 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 19.6 m -132.93 162.34 58.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.478 0.711 . . . . 0.0 110.183 -175.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.6 115.86 2.75 Favored 'Trans proline' 0 C--N 1.379 2.175 0 C-N-CA 122.972 2.448 . . . . 0.0 112.247 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 70.54 9.89 7.02 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.42 1.488 . . . . 0.0 112.386 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.694 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 28.0 m -124.58 121.77 35.7 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.258 0.623 . . . . 0.0 109.418 -174.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -107.67 165.83 11.14 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.272 1.029 . . . . 0.0 109.591 -172.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 52.2 t -146.15 158.58 43.88 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 43.5 tp -69.46 138.35 53.38 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.477 0.486 . . . . 0.0 110.186 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.969 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 176.116 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 . . . . . 0 N--CA 1.478 0.966 0 N-CA-C 111.93 0.344 . . . . 0.0 111.93 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.05 -29.13 72.39 Favored Glycine 0 C--N 1.343 0.929 0 O-C-N 123.996 0.81 . . . . 0.0 112.592 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -84.01 -31.89 25.21 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD11 HD23 ' A' ' 51' ' ' LEU . 2.4 tm? -65.16 -42.29 93.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.322 1.049 . . . . 0.0 109.059 172.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -62.88 -43.57 98.44 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.1 1.36 . . . . 0.0 109.444 173.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.1 tm0? -60.81 -44.12 97.29 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.006 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.417 ' O ' HG23 ' A' ' 27' ' ' VAL . 27.7 tpt180 -68.47 -43.29 77.28 Favored 'General case' 0 C--N 1.347 0.483 0 O-C-N 123.685 0.616 . . . . 0.0 111.141 -177.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 84.7 mt -57.07 -50.33 76.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.88 -32.5 74.04 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.503 0.721 . . . . 0.0 111.29 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 20.2 tp60 -68.93 -45.27 71.22 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 123.003 0.521 . . . . 0.0 110.1 -179.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 23' ' ' ARG . 80.5 t -62.06 -36.79 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.386 0.674 . . . . 0.0 110.303 177.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 96.2 mt -66.14 -39.91 90.2 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.552 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 62.6 m -72.03 -48.6 43.36 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.328 1.051 . . . . 0.0 111.984 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.8 mm-40 -68.65 -34.85 76.43 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 118.085 0.402 . . . . 0.0 111.141 -175.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.07 -39.36 90.02 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.351 170.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.12 23.03 59.09 Favored Glycine 0 C--N 1.356 1.659 0 O-C-N 123.86 0.725 . . . . 0.0 112.321 -174.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -153.43 150.15 22.91 Favored Pre-proline 0 C--O 1.24 0.569 0 C-N-CA 124.574 1.15 . . . . 0.0 108.346 -169.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.594 ' HB3' ' SG ' ' A' ' 73' ' ' CYS . 6.1 Cg_endo -48.53 112.77 0.67 Allowed 'Trans proline' 0 C--N 1.375 1.969 0 C-N-CA 123.804 3.002 . . . . 0.0 113.026 175.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 85.4 t -96.82 136.72 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -77.53 155.93 31.29 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.462 ' O ' HG23 ' A' ' 41' ' ' VAL . 23.0 tp -64.27 -46.23 84.58 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.045 0.938 . . . . 0.0 109.122 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.31 -44.37 33.87 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 0.0 112.48 168.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.69 -32.34 65.71 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 117.953 0.342 . . . . 0.0 110.363 179.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.6 mt -62.15 -35.63 79.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.849 0.459 . . . . 0.0 110.198 176.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 37' ' ' LEU . 61.2 t -56.06 -54.7 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.353 0.661 . . . . 0.0 111.563 177.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -71.98 -45.81 59.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.527 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.44 -39.62 94.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 68.5 m -82.24 -18.54 42.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 119.242 -0.408 . . . . 0.0 111.426 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 59.11 31.55 21.39 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.831 0.852 . . . . 0.0 109.905 -173.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.28 146.79 45.5 Favored Pre-proline 0 C--O 1.241 0.642 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.239 -169.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -63.76 129.41 24.74 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 122.802 2.335 . . . . 0.0 112.391 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -51.78 -28.67 16.16 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 124.341 1.026 . . . . 0.0 112.925 177.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.3 mtm180 -53.96 -57.03 12.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.525 0.73 . . . . 0.0 110.392 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.423 ' O ' HG23 ' A' ' 54' ' ' VAL . 1.1 mp0 -66.75 -44.45 81.47 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.768 -175.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.482 HD23 HD11 ' A' ' 20' ' ' LEU . 92.2 mt -55.71 -56.38 21.08 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 124.208 0.942 . . . . 0.0 110.401 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -48.7 -53.11 20.11 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.798 1.239 . . . . 0.0 111.374 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -52.15 -56.89 11.67 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 124.1 0.96 . . . . 0.0 112.619 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.664 HG12 ' SD ' ' A' ' 58' ' ' MET . 60.7 t -66.68 -35.56 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.001 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.3 mt -52.15 -48.79 64.72 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.479 1.111 . . . . 0.0 113.262 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -73.88 -25.18 59.9 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 118.253 0.479 . . . . 0.0 110.782 -175.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -67.59 -52.28 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.587 0.755 . . . . 0.0 109.418 172.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.664 ' SD ' HG12 ' A' ' 54' ' ' VAL . 70.7 mtp -59.74 -26.58 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.489 1.116 . . . . 0.0 111.368 176.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -70.99 -37.2 72.71 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.777 0.431 . . . . 0.0 110.167 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.31 -30.67 68.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.088 0.555 . . . . 0.0 110.412 173.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -77.62 -5.66 51.09 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.267 0.627 . . . . 0.0 111.271 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 55.4 mt 68.13 17.58 9.41 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.884 1.274 . . . . 0.0 111.037 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -81.75 -28.67 33.21 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.889 1.276 . . . . 0.0 111.803 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 32.9 m -130.86 158.8 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.225 0.61 . . . . 0.0 109.665 174.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.5 m -143.65 149.45 37.28 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -101.28 108.54 20.21 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.428 HG21 ' SG ' ' A' ' 73' ' ' CYS . 33.7 p -99.04 -32.21 11.39 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.25 0.548 . . . . 0.0 111.093 -176.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.564 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 35.8 t -140.22 153.83 69.36 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -43.67 114.18 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.519 0 C-N-CA 123.549 2.833 . . . . 0.0 114.011 175.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 59.8 26.89 16.11 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.753 1.221 . . . . 0.0 112.117 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.564 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 41.9 m -130.88 125.33 33.28 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 123.259 0.624 . . . . 0.0 109.516 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -117.44 146.53 43.41 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.023 0.929 . . . . 0.0 109.205 -170.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.594 ' SG ' ' HB3' ' A' ' 34' ' ' PRO . 78.4 m -113.68 158.66 20.59 Favored 'General case' 0 C--O 1.25 1.115 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 33.1 tp -64.97 102.31 0.6 Allowed 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.988 174.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.335 0.497 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.945 178.331 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 . . . . . 0 N--CA 1.479 1.023 0 N-CA-C 111.618 0.229 . . . . 0.0 111.618 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.18 -39.34 94.38 Favored Glycine 0 C--N 1.344 1.024 0 O-C-N 123.351 0.407 . . . . 0.0 113.683 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -77.77 -30.95 51.7 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.702 0.401 . . . . 0.0 110.209 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.536 HD22 ' SG ' ' A' ' 44' ' ' CYS . 3.0 tm? -60.92 -46.99 88.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.839 1.256 . . . . 0.0 109.529 173.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.672 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 21.0 tt0 -58.19 -51.6 69.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.799 1.24 . . . . 0.0 110.352 177.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -63.95 -34.66 78.48 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.68 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -68.66 -46.15 69.88 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.078 0.551 . . . . 0.0 112.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.5 mt -59.33 -50.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 122.753 0.421 . . . . 0.0 110.111 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.9 mt -64.87 -31.89 73.33 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.317 0.647 . . . . 0.0 110.636 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.474 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 22.1 tt0 -68.68 -47.95 65.17 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.103 0.561 . . . . 0.0 110.14 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.58 -36.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.246 1.018 . . . . 0.0 110.848 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 89.1 mt -67.48 -40.29 85.28 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.644 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 53.1 m -66.12 -48.04 72.15 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.015 0.926 . . . . 0.0 111.428 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 21.9 mm-40 -67.91 -38.94 83.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.457 0.703 . . . . 0.0 111.575 -174.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.52 96.14 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.877 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.96 28.57 72.21 Favored Glycine 0 C--N 1.351 1.389 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.057 -172.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.2 m -153.8 158.55 32.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 124.428 1.091 . . . . 0.0 109.029 -169.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -60.49 122.03 10.66 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.219 1.946 . . . . 0.0 112.106 169.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.3 t -107.74 130.68 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.432 1.093 . . . . 0.0 108.756 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.601 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.6 mttt -66.81 152.53 45.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 122.966 0.506 . . . . 0.0 110.837 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.498 ' O ' HG23 ' A' ' 41' ' ' VAL . 27.6 tp -59.72 -45.27 92.67 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 123.949 0.781 . . . . 0.0 109.817 174.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.33 -42.69 2.28 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.909 1.283 . . . . 0.0 113.818 168.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -84.68 -29.79 25.34 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.64 -33.03 74.2 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.728 0.411 . . . . 0.0 110.201 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.512 ' HA ' HD11 ' A' ' 51' ' ' LEU . 42.8 t -59.46 -55.15 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.56 0.744 . . . . 0.0 111.716 175.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -71.93 -39.58 69.35 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.456 -174.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -67.32 -50.53 59.71 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.947 0.499 . . . . 0.0 111.92 177.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.536 ' SG ' HD22 ' A' ' 20' ' ' LEU . 10.0 t -79.11 -12.85 60.01 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.842 0.457 . . . . 0.0 110.911 -175.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 61.78 28.97 17.84 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.818 1.247 . . . . 0.0 111.868 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -122.14 155.59 61.16 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 123.953 0.901 . . . . 0.0 111.367 -172.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.64 129.44 23.63 Favored 'Trans proline' 0 C--N 1.381 2.28 0 C-N-CA 122.169 1.912 . . . . 0.0 111.548 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.528 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.9 ttmt -45.26 -41.01 8.09 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 124.722 1.209 . . . . 0.0 113.027 175.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -54.14 -46.92 72.35 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.269 1.027 . . . . 0.0 112.031 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -66.5 -43.49 85.16 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.652 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 48' ' ' LYS . 85.2 mt -56.83 -52.02 66.71 Favored 'General case' 0 C--N 1.358 0.974 0 O-C-N 124.227 0.954 . . . . 0.0 111.252 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -48.47 -55.89 9.73 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.625 1.17 . . . . 0.0 111.966 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -60.56 -41.6 94.89 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.79 -174.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.4 t -69.56 -44.11 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 122.497 0.319 . . . . 0.0 110.299 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.401 HD13 ' NE1' ' A' ' 72' ' ' TRP . 35.4 mt -50.68 -49.49 57.21 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.917 1.287 . . . . 0.0 113.254 178.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.428 ' O ' ' HG2' ' A' ' 60' ' ' LYS . 69.1 m-85 -70.4 -27.55 64.38 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 119.038 0.835 . . . . 0.0 111.33 -177.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -72.26 -44.74 62.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.333 0.653 . . . . 0.0 109.496 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.672 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 71.5 mtm -64.49 -31.12 72.19 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.54 0.736 . . . . 0.0 111.217 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -66.61 -35.19 79.6 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.17 0.988 . . . . 0.0 110.974 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 56' ' ' TYR . 74.3 mmtt -57.51 -36.8 72.02 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.493 0.717 . . . . 0.0 111.14 170.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -90.55 5.1 49.2 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.321 1.048 . . . . 0.0 111.174 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 61.26 20.37 10.97 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.484 1.514 . . . . 0.0 112.798 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 95.2 mttt -70.68 -38.96 73.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.703 0.801 . . . . 0.0 110.637 176.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.5 m -125.04 154.21 32.89 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 C-N-CA 123.778 0.831 . . . . 0.0 109.356 175.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -138.88 143.88 38.94 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.405 1.082 . . . . 0.0 108.594 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.22 105.14 17.25 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -173.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.8 p -87.25 -36.92 17.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.706 0.802 . . . . 0.0 111.578 -173.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.541 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 27.7 m -137.14 163.79 46.68 Favored Pre-proline 0 CA--C 1.551 0.986 0 CA-C-O 117.526 -1.226 . . . . 0.0 107.709 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.414 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 25.6 Cg_exo -20.37 -63.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.399 3.205 1 C-N-CA 125.967 4.445 . . . . 0.0 116.785 -176.265 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.77 10.39 8.97 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.228 0.611 . . . . 0.0 112.061 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.601 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 26.5 m -85.41 126.95 34.19 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.87 0.366 . . . . 0.0 110.562 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.401 ' NE1' HD13 ' A' ' 55' ' ' LEU . 90.7 m95 -108.15 166.17 10.94 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.549 1.14 . . . . 0.0 109.402 -177.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 47.4 t -150.17 157.22 42.87 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.585 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 29.3 tp -79.31 112.76 16.86 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.528 0.871 0 O-C-N 123.816 0.698 . . . . 0.0 112.336 176.3 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 . . . . . 0 N--CA 1.484 1.24 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.35 -27.88 73.35 Favored Glycine 0 N--CA 1.472 1.056 0 O-C-N 123.419 0.449 . . . . 0.0 114.008 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -75.74 -38.0 58.85 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.617 0.767 . . . . 0.0 110.288 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.482 HD12 HG21 ' A' ' 54' ' ' VAL . 2.6 tm? -64.3 -41.63 96.77 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.058 0.943 . . . . 0.0 109.976 175.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 43.0 tt0 -63.52 -40.61 97.49 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.123 0.969 . . . . 0.0 110.422 173.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.52 -36.97 84.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.9 177.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.439 ' O ' HG23 ' A' ' 27' ' ' VAL . 1.3 mmp_? -62.07 -50.4 72.11 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.193 0.597 . . . . 0.0 110.961 172.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.2 mt -56.64 -47.97 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.024 0.828 . . . . 0.0 110.442 -176.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.605 HD21 ' HB3' ' A' ' 63' ' ' LYS . 78.1 mt -60.54 -46.81 88.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.515 0.726 . . . . 0.0 111.57 178.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -66.21 -43.18 87.45 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 123.668 0.605 . . . . 0.0 111.116 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 23' ' ' ARG . 70.9 t -61.02 -46.27 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.443 0.697 . . . . 0.0 110.163 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.46 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.8 mt -66.81 -29.74 69.75 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.677 -179.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.506 ' HA ' HD22 ' A' ' 74' ' ' LEU . 89.3 m -72.33 -49.77 31.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.717 0.807 . . . . 0.0 111.725 176.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.81 -32.25 72.68 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.107 0.563 . . . . 0.0 110.992 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.75 -41.17 88.22 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.312 0.645 . . . . 0.0 110.89 169.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.45 23.35 64.6 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.941 -172.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -158.57 158.73 29.69 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 125.221 1.408 . . . . 0.0 109.091 -167.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 73' ' ' CYS . 19.4 Cg_endo -60.34 128.32 25.81 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.512 2.141 . . . . 0.0 112.253 172.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.8 t -106.54 140.07 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 124.425 1.09 . . . . 0.0 108.201 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -74.46 157.97 34.65 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 123.5 0.72 . . . . 0.0 110.854 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 34.3 tp -68.13 -44.9 75.05 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.355 1.062 . . . . 0.0 111.068 -174.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.12 -34.83 10.42 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 168.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.482 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 49.6 tt0 -85.91 -29.45 23.62 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.93 -25.95 68.37 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.677 0.391 . . . . 0.0 110.331 176.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.659 ' HA ' HD11 ' A' ' 51' ' ' LEU . 60.0 t -64.22 -51.43 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 122.991 0.516 . . . . 0.0 110.474 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -74.95 -47.16 30.9 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.603 0.565 . . . . 0.0 111.612 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.482 ' HG2' ' HG2' ' A' ' 39' ' ' GLN . 46.5 mm-40 -61.54 -49.41 76.82 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 59.1 m -82.1 -8.96 59.68 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 56.92 46.55 19.39 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.698 1.199 . . . . 0.0 111.955 176.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.36 146.8 26.28 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.778 178.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -54.72 150.04 38.01 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.116 2.544 . . . . 0.0 112.998 172.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.494 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.1 ttmt -50.29 -34.67 24.32 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.86 1.264 . . . . 0.0 111.99 175.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -53.29 -48.93 67.95 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.166 0.987 . . . . 0.0 112.009 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 1.9 mp0 -66.25 -47.05 75.01 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.46 177.718 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.659 HD11 ' HA ' ' A' ' 41' ' ' VAL . 41.9 mt -59.84 -58.83 6.85 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.572 -173.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -52.66 -52.86 53.9 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 124.632 1.207 . . . . 0.0 112.074 -174.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.18 -37.07 76.48 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.028 0.83 . . . . 0.0 111.614 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.482 HG21 HD12 ' A' ' 20' ' ' LEU . 87.9 t -73.09 -41.98 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 173.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.7 -37.21 78.21 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.405 1.082 . . . . 0.0 113.693 -175.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -73.21 -27.64 61.73 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 118.652 0.66 . . . . 0.0 110.691 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.408 HH21 ' CD ' ' A' ' 21' ' ' GLU . 4.1 ptt180 -70.79 -44.97 65.53 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.476 ' HB3' ' HB2' ' A' ' 63' ' ' LYS . 92.6 mtp -66.88 -37.88 85.25 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 124.419 1.088 . . . . 0.0 111.116 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.4 -38.62 90.51 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.678 0.391 . . . . 0.0 110.338 178.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.97 -27.63 67.61 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.663 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -91.33 8.73 34.67 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.983 0.913 . . . . 0.0 112.39 176.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 63.44 17.16 10.12 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 123.806 0.842 . . . . 0.0 112.263 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.605 ' HB3' HD21 ' A' ' 25' ' ' LEU . 98.3 mttt -82.27 -34.91 28.54 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 124.124 0.97 . . . . 0.0 111.4 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.439 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 18.8 m -132.85 162.53 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.227 0.611 . . . . 0.0 109.997 176.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.6 m -131.06 142.95 50.34 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.411 0.684 . . . . 0.0 109.543 175.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 41.8 tp -92.51 101.08 13.52 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 175.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 31.9 p -85.13 -37.25 20.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.835 0.854 . . . . 0.0 111.667 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.513 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 15.9 t -140.32 155.1 70.3 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_exo -26.84 -59.51 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.52 1 C-N-CA 125.356 4.037 . . . . 0.0 116.865 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -120.05 42.06 3.03 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 111.178 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.513 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 34.1 m -131.95 126.7 34.69 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 123.239 0.616 . . . . 0.0 109.657 174.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -120.87 140.77 51.33 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.228 1.011 . . . . 0.0 109.064 -172.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 50.8 t -117.9 162.74 17.63 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 123.833 0.853 . . . . 0.0 110.168 -175.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 29' ' ' THR . 41.3 tp -69.78 105.69 2.85 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 172.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.439 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . . . . . . 0 C--N 1.335 0.502 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 171.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 . . . . . 0 CA--C 1.54 0.587 0 N-CA-C 112.363 0.505 . . . . 0.0 112.363 . . . . . . . . . 0 0 . 1 . 006 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.09 -36.84 94.01 Favored Glycine 0 C--N 1.348 1.224 0 N-CA-C 113.747 0.259 . . . . 0.0 113.747 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -71.58 -39.26 70.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.68 0.392 . . . . 0.0 110.287 177.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 51' ' ' LEU . 2.0 tm? -63.24 -46.5 86.64 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.758 1.223 . . . . 0.0 109.566 177.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.51 -47.18 82.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.624 1.169 . . . . 0.0 110.306 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -63.21 -39.04 93.5 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.454 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.458 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -64.59 -43.27 94.35 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.0 0.52 . . . . 0.0 110.237 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 20' ' ' LEU . 87.5 mt -58.43 -52.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 123.977 0.798 . . . . 0.0 110.076 177.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' A' ' 63' ' ' LYS . 96.0 mt -56.8 -38.45 72.58 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.599 0.76 . . . . 0.0 111.01 -178.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -65.17 -48.91 71.83 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.316 1.01 . . . . 0.0 110.99 -178.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 23' ' ' ARG . 93.5 t -57.55 -41.71 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.596 0.758 . . . . 0.0 110.825 177.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 85.4 mt -63.95 -38.92 92.84 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.953 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.2 m -69.69 -46.12 66.76 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 123.616 0.766 . . . . 0.0 111.495 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.19 -38.31 90.65 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.527 0.731 . . . . 0.0 110.942 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.38 -44.19 83.78 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.509 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 20.19 66.89 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.194 -173.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 54.9 p -159.92 153.79 19.48 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.915 1.286 . . . . 0.0 109.155 -168.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.48 123.53 9.38 Favored 'Trans proline' 0 C--N 1.378 2.114 0 C-N-CA 123.65 2.9 . . . . 0.0 114.155 -178.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.3 t -108.51 129.73 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 124.626 1.171 . . . . 0.0 108.611 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 61.0 mttp -70.52 153.55 42.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.994 0.518 . . . . 0.0 110.66 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.474 ' O ' HG23 ' A' ' 41' ' ' VAL . 53.5 tp -59.76 -48.11 83.0 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 123.885 0.74 . . . . 0.0 109.993 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.31 -41.64 19.56 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.576 1.15 . . . . 0.0 113.071 170.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 53.4 tt0 -73.29 -37.68 66.14 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 122.933 0.493 . . . . 0.0 110.734 178.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.41 -34.97 73.11 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.361 0.664 . . . . 0.0 110.466 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 37' ' ' LEU . 35.9 t -56.88 -56.64 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.642 0.777 . . . . 0.0 111.711 176.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -69.29 -37.96 78.08 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 123.726 0.641 . . . . 0.0 111.735 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 29.7 mm-40 -63.75 -55.82 20.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.098 0.559 . . . . 0.0 111.911 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 41.8 t -76.95 -18.43 58.25 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 122.778 0.431 . . . . 0.0 110.792 -174.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 62.21 23.78 14.1 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.942 1.297 . . . . 0.0 110.996 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.19 153.15 49.77 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.554 1.142 . . . . 0.0 109.829 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.487 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 10.5 Cg_endo -54.37 131.16 43.72 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.032 2.488 . . . . 0.0 112.45 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -42.51 -44.89 4.28 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.168 1.387 . . . . 0.0 113.488 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.412 ' HG3' ' N ' ' A' ' 50' ' ' GLU . 47.7 ptt85 -57.66 -39.93 78.16 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 123.765 0.666 . . . . 0.0 111.829 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.487 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 6.2 tp10 -66.53 -49.38 66.69 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 123.566 0.746 . . . . 0.0 109.933 -178.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.585 ' HA ' HD11 ' A' ' 20' ' ' LEU . 22.3 mt -58.56 -57.21 13.95 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.666 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.464 ' HA ' HD12 ' A' ' 55' ' ' LEU . 22.0 t-20 -50.47 -53.74 27.43 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.697 1.599 . . . . 0.0 112.402 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -58.0 -49.39 77.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.248 0.619 . . . . 0.0 111.702 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.483 HG12 ' SD ' ' A' ' 58' ' ' MET . 70.3 t -63.91 -37.57 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.383 0.673 . . . . 0.0 110.675 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 52' ' ' ASN . 32.1 mt -54.08 -35.2 61.82 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.441 1.096 . . . . 0.0 112.751 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -69.93 -34.55 73.61 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.466 0.576 . . . . 0.0 111.782 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -66.7 -49.25 66.68 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.483 ' SD ' HG12 ' A' ' 54' ' ' VAL . 72.4 mtp -62.0 -36.01 80.23 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.263 1.025 . . . . 0.0 111.335 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -64.44 -39.58 94.09 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.943 0.897 . . . . 0.0 111.78 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -67.72 -25.94 65.91 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.316 0.646 . . . . 0.0 111.453 175.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -89.53 4.74 48.3 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.56 0.744 . . . . 0.0 110.616 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 62.18 13.61 5.98 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.136 1.375 . . . . 0.0 112.642 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.543 ' HB3' HD21 ' A' ' 25' ' ' LEU . 94.5 mttt -66.5 -39.45 88.71 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.352 1.061 . . . . 0.0 110.431 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.1 m -125.47 160.78 31.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-N 114.856 -1.065 . . . . 0.0 108.9 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.57 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 70.8 m -137.68 143.82 41.5 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.995 0.918 . . . . 0.0 108.705 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.6 101.0 12.54 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 t -92.94 -33.68 14.08 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.014 -171.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.679 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 18.5 m -139.07 162.71 50.76 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.079 0.952 . . . . 0.0 108.717 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.67 111.74 0.77 Allowed 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 122.941 2.428 . . . . 0.0 113.281 178.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 63.79 26.37 14.37 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.79 1.236 . . . . 0.0 111.538 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.679 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 87.5 m -130.2 125.6 35.33 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.769 0.828 . . . . 0.0 108.927 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -113.46 171.28 7.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.133 0.973 . . . . 0.0 109.449 -172.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.57 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 20.0 p -152.6 160.12 43.21 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.606 0.763 . . . . 0.0 109.008 177.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.602 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 26.1 tp -78.05 101.86 7.15 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.341 0.806 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.19 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 . . . . . 0 C--O 1.22 -0.472 0 CA-C-O 118.772 -0.633 . . . . 0.0 111.738 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.69 -48.98 73.35 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-O 119.858 -0.412 . . . . 0.0 114.091 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -66.52 -47.34 73.23 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.989 0.515 . . . . 0.0 111.583 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.628 HD12 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -63.36 -40.54 97.55 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.721 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.1 tt0 -61.83 -48.36 80.9 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.572 1.149 . . . . 0.0 110.354 177.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -57.76 -41.08 81.2 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.484 0.713 . . . . 0.0 109.928 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.468 ' O ' HG23 ' A' ' 27' ' ' VAL . 20.2 mmm180 -68.28 -44.63 75.12 Favored 'General case' 0 C--N 1.352 0.695 0 C-N-CA 123.541 0.737 . . . . 0.0 112.398 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 53.9 mt -59.83 -50.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 21' ' ' GLU . 79.4 mt -63.92 -33.45 75.73 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.756 0.66 . . . . 0.0 110.744 -176.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -69.09 -43.72 73.93 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.469 0.708 . . . . 0.0 110.594 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 23' ' ' ARG . 72.8 t -62.66 -34.94 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.537 178.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 78.3 mt -66.62 -37.34 84.65 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.211 175.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -67.37 -52.72 36.65 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 124.193 0.997 . . . . 0.0 111.599 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -69.79 -31.46 69.4 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.102 0.561 . . . . 0.0 111.7 -171.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.94 -38.34 90.64 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.751 167.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.07 25.3 70.84 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.521 -175.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.6 p -161.17 159.75 24.33 Favored Pre-proline 0 C--O 1.245 0.859 0 C-N-CA 125.25 1.42 . . . . 0.0 109.105 -172.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.98 126.16 21.31 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.109 1.873 . . . . 0.0 112.773 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 89.3 t -104.03 138.38 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.126 0.97 . . . . 0.0 108.663 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -73.9 152.15 40.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.418 ' O ' HG23 ' A' ' 41' ' ' VAL . 26.2 tp -61.86 -46.51 89.11 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.859 0.863 . . . . 0.0 109.846 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.45 -45.05 3.06 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.902 1.281 . . . . 0.0 112.816 167.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.422 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 62.3 tt0 -79.79 -30.55 40.66 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.911 0.484 . . . . 0.0 111.034 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.97 -30.82 71.87 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.161 0.584 . . . . 0.0 110.997 178.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.5 ' HA ' HD11 ' A' ' 51' ' ' LEU . 64.4 t -55.75 -56.35 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.692 0.797 . . . . 0.0 112.024 176.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.422 ' HE2' ' HG3' ' A' ' 39' ' ' GLN . 63.2 pttt -68.85 -42.44 77.12 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 123.567 0.542 . . . . 0.0 111.668 -175.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -66.92 -49.39 65.68 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.516 0.727 . . . . 0.0 112.089 -177.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 56.9 m -81.35 -9.94 59.64 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 122.376 0.271 . . . . 0.0 110.805 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 60.13 29.49 19.05 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.481 1.112 . . . . 0.0 111.401 175.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.7 156.06 65.45 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 123.525 0.73 . . . . 0.0 111.003 -173.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.62 133.0 32.67 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.644 2.229 . . . . 0.0 111.938 174.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -46.97 -36.69 8.01 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.959 1.303 . . . . 0.0 113.072 174.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.0 mtm180 -54.6 -49.09 71.27 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.665 0.786 . . . . 0.0 110.957 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -67.15 -46.96 72.49 Favored 'General case' 0 C--O 1.25 1.126 0 C-N-CA 123.891 0.876 . . . . 0.0 110.659 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.507 HD23 HD11 ' A' ' 20' ' ' LEU . 95.9 mt -53.68 -51.74 62.25 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.997 0.919 . . . . 0.0 111.496 -176.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -53.47 -50.99 64.15 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 124.621 1.201 . . . . 0.0 112.444 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -57.07 -39.88 75.81 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.993 0.808 . . . . 0.0 111.269 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.628 HG21 HD12 ' A' ' 20' ' ' LEU . 98.2 t -71.49 -43.79 71.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.567 0.747 . . . . 0.0 110.993 176.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.455 HD13 ' NE1' ' A' ' 72' ' ' TRP . 79.6 mt -54.04 -45.05 71.53 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.474 1.109 . . . . 0.0 113.368 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.78 -25.4 59.04 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.112 0.414 . . . . 0.0 111.534 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -68.37 -53.52 23.4 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.721 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 68.7 mtm -60.79 -31.86 71.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.995 0.918 . . . . 0.0 110.987 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -62.62 -46.81 86.55 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.828 0.851 . . . . 0.0 110.861 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.415 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 4.9 ttmp? -68.18 -26.11 65.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.443 0.697 . . . . 0.0 111.418 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -90.4 -0.0 57.46 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.314 0.646 . . . . 0.0 111.516 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 67.75 10.99 8.16 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 124.928 1.291 . . . . 0.0 112.845 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.532 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.1 mttt -69.51 -28.24 65.88 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.656 0.783 . . . . 0.0 111.04 174.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.0 161.23 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.544 0.738 . . . . 0.0 110.048 171.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.7 m -139.08 152.21 47.34 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.75 0.82 . . . . 0.0 108.876 172.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.7 tp -101.25 106.96 18.22 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.2 p -92.97 -39.79 10.92 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.636 0.775 . . . . 0.0 111.178 -175.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.509 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 25.3 m -140.68 167.04 18.97 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 123.854 0.861 . . . . 0.0 109.249 -173.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.71 112.43 0.69 Allowed 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 123.124 2.549 . . . . 0.0 113.429 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 62.63 18.96 10.98 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.372 1.069 . . . . 0.0 112.856 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.509 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 31.4 m -119.78 123.17 43.07 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 123.574 0.75 . . . . 0.0 110.0 -174.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.455 ' NE1' HD13 ' A' ' 55' ' ' LEU . 62.5 m95 -119.32 151.63 38.12 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.339 1.055 . . . . 0.0 109.614 -169.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 24.4 p -128.22 157.03 41.98 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 109.337 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 46.3 tp -77.61 131.19 37.68 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.937 0.495 . . . . 0.0 110.839 -178.558 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.349 1.281 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 171.69 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 . . . . . 0 N--CA 1.47 0.531 0 N-CA-C 112.103 0.409 . . . . 0.0 112.103 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.32 -38.86 96.94 Favored Glycine 0 C--N 1.342 0.878 0 O-C-N 123.392 0.433 . . . . 0.0 113.012 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.5 m-70 -73.43 -36.21 65.9 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.191 0.52 . . . . 0.0 110.52 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.523 HD12 HG21 ' A' ' 54' ' ' VAL . 2.0 tm? -65.82 -42.53 90.49 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.304 1.042 . . . . 0.0 110.148 174.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -61.35 -42.8 99.28 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.787 0.835 . . . . 0.0 109.898 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -42.54 93.92 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.948 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.438 ' O ' HG23 ' A' ' 27' ' ' VAL . 12.7 tpt180 -67.16 -42.27 84.59 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.137 -177.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 78.5 mt -57.01 -49.61 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 O-C-N 123.909 0.756 . . . . 0.0 109.876 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 63' ' ' LYS . 92.0 mt -59.24 -39.59 83.25 Favored 'General case' 0 C--N 1.349 0.547 0 O-C-N 123.987 0.804 . . . . 0.0 111.142 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -66.62 -45.44 79.1 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.667 0.605 . . . . 0.0 110.911 -176.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 23' ' ' ARG . 86.6 t -56.34 -42.83 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.289 0.636 . . . . 0.0 110.279 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 97.8 mt -71.9 -34.59 69.25 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.635 -177.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.45 ' HA ' HD22 ' A' ' 74' ' ' LEU . 27.3 m -70.63 -45.65 64.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.314 0.646 . . . . 0.0 111.68 179.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.1 -33.17 74.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.913 0.485 . . . . 0.0 110.867 -177.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.68 -44.88 66.11 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.705 0.628 . . . . 0.0 110.345 172.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.42 25.52 67.0 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.782 -170.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.7 m -148.41 155.29 42.46 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 124.082 0.953 . . . . 0.0 110.314 -166.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -60.53 109.21 0.61 Allowed 'Trans proline' 0 C--N 1.368 1.564 0 C-N-CA 123.063 2.509 . . . . 0.0 112.089 169.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.5 t -97.12 130.65 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.991 0.916 . . . . 0.0 108.531 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.64 153.29 43.64 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 41' ' ' VAL . 36.1 tp -59.18 -45.46 90.99 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.991 0.807 . . . . 0.0 110.23 -178.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.58 -47.27 10.29 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.362 1.065 . . . . 0.0 112.94 170.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.436 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.9 tt0 -77.32 -34.89 55.27 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.002 0.521 . . . . 0.0 110.397 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.8 mt -56.76 -41.51 77.72 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.618 0.767 . . . . 0.0 110.591 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 37' ' ' LEU . 92.1 t -53.59 -56.34 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 124.243 0.965 . . . . 0.0 111.635 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -74.59 -35.18 62.99 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.27 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 13.7 mm-40 -69.98 -45.86 66.44 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 122.713 0.405 . . . . 0.0 112.088 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.589 ' SG ' ' HB3' ' A' ' 46' ' ' ALA . 23.8 p -72.6 -19.66 61.43 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.399 0.279 . . . . 0.0 111.042 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 64.8 37.84 7.1 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 124.292 1.037 . . . . 0.0 110.106 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.589 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -134.64 159.45 72.16 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.679 -173.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.71 134.81 22.68 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.426 2.084 . . . . 0.0 111.95 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -50.21 -31.84 14.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.669 1.188 . . . . 0.0 113.086 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -61.03 -48.64 80.84 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 122.622 0.369 . . . . 0.0 111.183 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -65.86 -46.61 77.8 Favored 'General case' 0 C--O 1.242 0.691 0 O-C-N 123.772 0.67 . . . . 0.0 110.55 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.569 HD21 ' SG ' ' A' ' 44' ' ' CYS . 93.8 mt -55.06 -58.61 6.95 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 124.267 0.98 . . . . 0.0 110.746 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -48.13 -53.24 17.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.658 1.583 . . . . 0.0 112.216 -174.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -56.52 -48.83 76.4 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 123.945 0.778 . . . . 0.0 112.423 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.585 HG12 ' SD ' ' A' ' 58' ' ' MET . 70.1 t -63.63 -43.73 98.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 123.734 0.647 . . . . 0.0 110.726 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 77.0 mt -50.7 -43.9 57.9 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.237 1.415 . . . . 0.0 113.739 -177.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.459 ' O ' ' HG3' ' A' ' 60' ' ' LYS . 92.5 m-85 -73.1 -30.92 64.0 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.508 0.595 . . . . 0.0 112.21 -178.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.4 ttt85 -74.02 -51.99 14.13 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.443 0.297 . . . . 0.0 110.209 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.585 ' SD ' HG12 ' A' ' 54' ' ' VAL . 19.7 ptm -65.82 -19.26 65.82 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.137 0.575 . . . . 0.0 110.812 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -65.46 -44.31 87.6 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.555 0.742 . . . . 0.0 110.759 171.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 56' ' ' TYR . 61.3 mttm -66.35 -31.68 72.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.637 0.775 . . . . 0.0 110.826 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -84.45 6.24 24.19 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.227 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.81 10.93 7.24 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.872 1.269 . . . . 0.0 112.305 176.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.602 ' HB3' HD21 ' A' ' 25' ' ' LEU . 92.3 mttt -70.85 -34.97 72.19 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.586 0.754 . . . . 0.0 110.505 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.509 HG22 ' HG3' ' A' ' 58' ' ' MET . 16.4 m -133.64 160.33 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.289 0.635 . . . . 0.0 109.731 174.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.1 m -125.45 150.6 47.17 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.5 tp -104.49 104.67 14.56 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.1 p -87.73 -42.75 12.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.73 0.812 . . . . 0.0 110.896 -172.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.502 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 30.7 m -139.84 170.63 9.41 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.035 0.934 . . . . 0.0 109.486 -174.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.32 106.49 0.08 OUTLIER 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 123.418 2.746 . . . . 0.0 114.071 173.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.04 20.0 10.46 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.765 1.226 . . . . 0.0 112.626 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.502 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 34.6 m -114.64 118.47 33.76 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.61 0.764 . . . . 0.0 109.153 -174.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 58.3 m95 -116.92 139.15 50.98 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.948 0.899 . . . . 0.0 109.314 -169.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 45.8 t -117.38 165.08 13.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.029 0.532 . . . . 0.0 109.902 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 29' ' ' THR . 45.5 tp -65.93 111.64 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 122.969 0.508 . . . . 0.0 110.112 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.465 0.57 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 175.303 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 . . . . . 0 N--CA 1.477 0.891 0 N-CA-C 112.769 0.655 . . . . 0.0 112.769 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.4 99.75 Favored Glycine 0 C--N 1.351 1.378 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -69.21 -45.65 69.36 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -177.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.564 HD11 HD23 ' A' ' 51' ' ' LEU . 2.6 tm? -64.69 -37.26 86.98 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.125 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -60.91 -50.85 71.76 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.235 1.014 . . . . 0.0 110.461 175.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -62.62 -31.87 72.79 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 124.617 1.198 . . . . 0.0 110.559 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -71.35 -44.11 65.68 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.11 0.564 . . . . 0.0 111.311 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.427 HD12 ' HE3' ' A' ' 58' ' ' MET . 79.5 mt -60.53 -47.41 92.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 177.094 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.67 -36.05 73.54 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.678 0.791 . . . . 0.0 110.66 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -65.45 -48.71 71.78 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.034 0.834 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 71.4 t -58.56 -39.42 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.883 0.873 . . . . 0.0 110.752 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -68.46 -38.89 81.5 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.098 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 67.5 m -72.18 -45.69 59.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.526 0.73 . . . . 0.0 111.991 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.16 -38.76 91.58 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.042 0.537 . . . . 0.0 110.969 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.83 83.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.414 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 67.2 22.53 72.72 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.322 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.1 p -151.39 166.73 14.49 Favored Pre-proline 0 C--O 1.246 0.901 0 C-N-CA 123.999 0.92 . . . . 0.0 109.697 -169.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.18 118.51 5.41 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.424 2.083 . . . . 0.0 111.918 171.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 99.1 t -102.5 125.29 56.8 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 67.2 mttm -69.52 155.08 41.04 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.981 0.512 . . . . 0.0 110.523 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 41' ' ' VAL . 33.4 tp -61.19 -49.75 75.92 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.419 0.688 . . . . 0.0 110.726 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.83 -38.37 15.81 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.841 0.857 . . . . 0.0 112.578 171.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.465 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 62.5 tt0 -75.36 -38.88 59.81 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 122.795 0.438 . . . . 0.0 110.574 176.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.8 mt -56.98 -40.59 76.81 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.422 0.689 . . . . 0.0 110.641 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 37' ' ' LEU . 51.7 t -55.22 -54.07 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 123.962 0.789 . . . . 0.0 111.639 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -69.53 -39.01 77.75 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.241 0.338 . . . . 0.0 111.375 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 46.6 mm-40 -64.35 -53.67 45.06 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.631 ' SG ' HD21 ' A' ' 51' ' ' LEU . 31.6 p -76.92 -24.45 52.44 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 122.721 0.408 . . . . 0.0 111.132 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 63.3 36.61 11.6 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.107 0.963 . . . . 0.0 110.919 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.429 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -118.81 150.47 48.51 Favored Pre-proline 0 C--O 1.242 0.697 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.394 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.08 135.84 45.5 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.207 1.938 . . . . 0.0 111.437 177.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -50.02 -33.28 17.58 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.683 1.193 . . . . 0.0 112.64 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -61.54 -45.06 95.77 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.581 0.752 . . . . 0.0 111.74 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -65.0 -50.16 67.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.618 0.767 . . . . 0.0 110.387 174.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.631 HD21 ' SG ' ' A' ' 44' ' ' CYS . 97.0 mt -53.95 -58.89 5.63 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 124.201 1.0 . . . . 0.0 112.01 -176.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.453 ' HA ' HD12 ' A' ' 55' ' ' LEU . 5.3 m-20 -55.7 -46.43 77.68 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.554 1.159 . . . . 0.0 111.953 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -54.08 -48.82 70.25 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 123.853 0.721 . . . . 0.0 110.691 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.486 HG21 HD12 ' A' ' 20' ' ' LEU . 56.9 t -70.15 -36.08 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.101 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' A' ' 52' ' ' ASN . 57.7 mt -53.55 -42.92 68.01 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.437 1.095 . . . . 0.0 113.649 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -72.62 -27.17 61.99 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 118.681 0.673 . . . . 0.0 111.405 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -67.35 -58.58 4.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.662 0.785 . . . . 0.0 110.473 176.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.545 ' SD ' HG11 ' A' ' 64' ' ' VAL . 14.4 ptp -61.56 -28.73 69.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.724 0.81 . . . . 0.0 111.561 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -65.89 -43.71 87.46 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 0.0 110.963 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.425 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 5.0 ttmp? -63.35 -39.24 94.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.716 0.806 . . . . 0.0 111.008 174.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -82.78 4.15 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.231 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.6 mt 63.03 15.04 8.11 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.365 1.466 . . . . 0.0 112.553 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.72 -23.15 60.81 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 124.411 1.084 . . . . 0.0 110.433 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.545 HG11 ' SD ' ' A' ' 58' ' ' MET . 13.3 m -130.52 170.09 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.115 0.566 . . . . 0.0 109.933 171.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.8 t -135.0 153.37 52.11 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.345 173.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.0 tp -101.25 101.82 12.58 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 176.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.4 p -81.52 -41.68 21.34 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.965 0.506 . . . . 0.0 110.444 -176.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.544 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 42.3 t -140.21 152.3 66.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.644 0.778 . . . . 0.0 108.915 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.16 124.37 8.9 Favored 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.135 2.557 . . . . 0.0 112.431 168.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 69.31 9.53 7.36 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.155 1.382 . . . . 0.0 112.715 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.544 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 58.3 m -129.02 120.04 25.32 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.64 0.776 . . . . 0.0 109.264 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -107.15 166.81 10.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.732 0.813 . . . . 0.0 108.867 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.3 t -152.82 165.13 36.35 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 22.3 tp -71.12 148.39 47.47 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 176.711 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.347 1.14 0 O-C-N 123.497 0.498 . . . . 0.0 112.256 -179.342 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 . . . . . 0 N--CA 1.481 1.109 0 N-CA-C 111.905 0.335 . . . . 0.0 111.905 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.41 74.26 Favored Glycine 0 C--N 1.345 1.058 0 O-C-N 123.971 0.794 . . . . 0.0 114.709 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -75.99 -38.68 57.12 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.186 0.594 . . . . 0.0 109.78 177.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.599 HD12 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -64.54 -43.64 93.34 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.712 176.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -65.55 -40.39 92.79 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.272 1.029 . . . . 0.0 110.043 176.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.0 -38.09 87.3 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.738 0.815 . . . . 0.0 110.223 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 27' ' ' VAL . 22.8 mmm180 -63.76 -50.83 67.5 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 122.737 0.415 . . . . 0.0 110.919 174.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.43 HG21 HD21 ' A' ' 55' ' ' LEU . 87.8 mt -56.1 -54.23 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 O-C-N 123.863 0.727 . . . . 0.0 110.354 -175.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 63' ' ' LYS . 90.0 mt -65.01 -35.43 81.17 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.953 0.901 . . . . 0.0 111.486 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -66.09 -47.4 74.33 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.296 0.638 . . . . 0.0 110.328 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 23' ' ' ARG . 61.1 t -59.81 -40.9 83.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 124.516 1.126 . . . . 0.0 111.205 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.57 -38.65 87.52 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.742 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 73.5 m -68.73 -50.46 50.53 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.121 0.968 . . . . 0.0 111.776 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -67.44 -40.46 85.44 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.97 0.508 . . . . 0.0 110.994 -173.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -42.19 98.8 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.386 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.76 29.4 64.4 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 115.164 -0.926 . . . . 0.0 112.249 -174.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.2 m -150.94 153.89 33.71 Favored Pre-proline 0 C--O 1.242 0.665 0 C-N-CA 125.296 1.438 . . . . 0.0 107.897 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -60.98 114.05 2.0 Allowed 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.194 1.929 . . . . 0.0 111.382 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.7 t -96.23 128.21 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.357 1.063 . . . . 0.0 108.281 -176.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 49.0 mtmt -58.58 154.72 13.68 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.447 0.699 . . . . 0.0 111.397 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.5 tp -67.43 -50.74 58.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.017 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -53.67 -28.1 31.42 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -81.88 -30.64 31.87 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.909 0.484 . . . . 0.0 109.882 177.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.36 -26.38 67.24 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.138 0.575 . . . . 0.0 110.087 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.448 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.5 t -58.52 -53.23 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.498 0.719 . . . . 0.0 111.4 174.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -70.79 -40.72 72.38 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -69.46 -51.77 32.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.972 0.509 . . . . 0.0 112.128 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 57.2 m -78.03 -13.22 59.95 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.385 0.274 . . . . 0.0 110.789 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 60.38 31.39 20.36 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.008 1.323 . . . . 0.0 111.891 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.24 154.43 56.13 Favored Pre-proline 0 N--CA 1.473 0.681 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.501 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.444 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 11.4 Cg_endo -56.12 136.72 76.56 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.81 2.34 . . . . 0.0 111.632 169.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.414 ' HA ' HD12 ' A' ' 51' ' ' LEU . 26.0 ttpp -48.96 -41.5 34.32 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.196 0.998 . . . . 0.0 112.225 172.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.444 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 21.8 ptt180 -59.0 -37.62 77.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.826 0.45 . . . . 0.0 111.924 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.41 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 23.8 tp10 -66.79 -50.15 63.58 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 123.727 0.811 . . . . 0.0 110.029 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.464 HD23 HD11 ' A' ' 20' ' ' LEU . 76.7 mt -57.22 -50.08 74.0 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.157 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -52.07 -51.54 56.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.465 1.103 . . . . 0.0 111.504 -176.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -66.86 -37.06 83.73 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 124.127 0.892 . . . . 0.0 111.524 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.704 HG12 ' SD ' ' A' ' 58' ' ' MET . 95.7 t -66.38 -47.52 83.76 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 24' ' ' ILE . 39.3 mt -57.72 -37.77 74.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.223 1.409 . . . . 0.0 112.888 177.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -68.54 -28.64 67.16 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 122.903 0.481 . . . . 0.0 111.413 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -71.54 -53.55 13.44 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 171.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.704 ' SD ' HG12 ' A' ' 54' ' ' VAL . 77.9 mtp -61.01 -32.38 71.98 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.971 1.308 . . . . 0.0 113.051 -172.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -70.44 -34.16 72.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.366 0.266 . . . . 0.0 111.162 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -71.54 -24.56 61.97 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.377 0.671 . . . . 0.0 110.326 173.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.07 5.8 42.79 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.368 1.067 . . . . 0.0 110.718 174.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 60.7 14.93 5.39 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.341 1.456 . . . . 0.0 112.775 177.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.537 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.3 mttt -73.97 -40.9 62.68 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.214 1.006 . . . . 0.0 110.838 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.1 m -126.45 158.35 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.492 0.717 . . . . 0.0 110.517 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.1 m -135.63 150.27 49.58 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.627 1.171 . . . . 0.0 108.323 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.1 tp -99.96 110.77 23.09 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.5 p -82.54 -46.39 13.44 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 -177.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.424 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.4 m -133.21 163.65 49.59 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.311 -1.328 . . . . 0.0 108.18 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 19.3 Cg_exo -25.52 -63.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.393 2.901 1 C-N-CA 125.464 4.109 . . . . 0.0 116.432 -174.913 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.58 53.59 1.74 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.613 0.765 . . . . 0.0 110.508 172.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 36.0 m -132.39 120.53 22.15 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 172.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -106.21 169.17 8.66 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.449 1.1 . . . . 0.0 109.273 -174.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.2 t -151.16 159.96 44.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.656 0.782 . . . . 0.0 109.633 -175.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 35.7 tp -72.89 104.3 4.0 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 174.634 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.34 0.751 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.64 177.623 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 110.237 -0.283 . . . . 0.0 110.237 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -54.42 -41.0 70.89 Favored Glycine 0 C--N 1.351 1.403 0 O-C-N 123.81 0.694 . . . . 0.0 114.37 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -75.76 -40.02 56.07 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.445 0.298 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.484 HD11 HD23 ' A' ' 51' ' ' LEU . 1.5 tm? -60.0 -52.8 63.86 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.817 1.247 . . . . 0.0 110.098 -178.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.759 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.8 tt0 -62.19 -44.66 96.1 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.995 1.318 . . . . 0.0 110.513 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -56.91 -44.98 82.93 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.37 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.438 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 0.8 OUTLIER -66.27 -47.7 72.82 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.312 0.645 . . . . 0.0 112.33 -178.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.8 mt -60.74 -50.99 78.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 123.589 0.556 . . . . 0.0 110.126 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -64.2 -38.36 90.77 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 111.806 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -71.47 -40.12 70.49 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.747 0.654 . . . . 0.0 110.456 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.4 t -61.89 -39.16 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.144 0.578 . . . . 0.0 110.032 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.42 -29.03 63.34 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.564 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . 0.481 ' HA ' HD22 ' A' ' 74' ' ' LEU . 86.4 m -75.49 -44.15 45.42 Favored 'General case' 0 C--N 1.353 0.755 0 C-N-CA 123.584 0.754 . . . . 0.0 111.395 176.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -70.11 -37.25 75.3 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.498 0.719 . . . . 0.0 110.229 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.33 -39.82 71.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 122.959 0.504 . . . . 0.0 109.7 172.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.53 31.5 67.01 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.751 -175.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -160.45 149.47 13.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.946 0.899 . . . . 0.0 109.091 -166.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -60.77 113.4 1.69 Allowed 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.976 2.451 . . . . 0.0 112.712 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.3 t -102.61 138.61 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.662 1.185 . . . . 0.0 108.208 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.87 149.48 50.53 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.347 0.659 . . . . 0.0 110.588 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 41' ' ' VAL . 25.3 tp -59.37 -49.08 79.19 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.555 1.159 . . . . 0.0 110.953 178.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.75 -36.98 17.63 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.107 0.963 . . . . 0.0 113.117 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.524 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 51.2 tt0 -76.66 -34.48 58.25 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.45 -29.24 69.89 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.288 0.635 . . . . 0.0 110.497 177.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.495 ' HA ' HD11 ' A' ' 51' ' ' LEU . 93.9 t -59.8 -53.09 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.839 0.855 . . . . 0.0 111.155 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HE2' ' HG3' ' A' ' 39' ' ' GLN . 63.5 pttt -73.41 -34.73 65.64 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 123.648 0.592 . . . . 0.0 111.487 -177.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 26.9 mm-40 -62.04 -55.86 24.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.63 0.372 . . . . 0.0 110.616 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 45.4 t -81.83 -10.82 59.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.674 0.39 . . . . 0.0 110.714 -174.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 56.32 32.62 20.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.787 1.235 . . . . 0.0 110.886 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.61 149.72 53.48 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.176 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -61.11 130.93 34.37 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.599 2.199 . . . . 0.0 111.609 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -44.53 -36.29 2.91 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.387 1.475 . . . . 0.0 112.924 172.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.264 1.025 . . . . 0.0 111.544 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.08 -39.52 75.56 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.229 0.612 . . . . 0.0 111.061 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 41' ' ' VAL . 93.9 mt -56.66 -52.46 64.82 Favored 'General case' 0 C--N 1.359 1.005 0 O-C-N 123.938 0.774 . . . . 0.0 110.67 175.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.8 m-20 -50.54 -51.39 48.27 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 125.137 1.375 . . . . 0.0 111.886 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -50.89 -52.83 37.94 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.336 1.054 . . . . 0.0 112.032 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.39 -37.86 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.471 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.414 HD13 ' NE1' ' A' ' 72' ' ' TRP . 38.8 mt -57.39 -46.02 83.88 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.863 1.265 . . . . 0.0 114.115 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -71.08 -28.76 64.57 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 119.271 0.941 . . . . 0.0 110.908 -178.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.43 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.5 tpp85 -66.73 -50.21 63.51 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.759 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 76.0 mtm -66.68 -27.53 67.73 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 124.109 0.963 . . . . 0.0 112.138 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -67.11 -40.37 86.87 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.583 0.753 . . . . 0.0 109.891 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -71.44 -34.54 70.37 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.873 0.733 . . . . 0.0 110.747 173.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 57' ' ' ARG . 51.0 mt-10 -76.69 -5.17 46.87 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.154 0.582 . . . . 0.0 111.197 174.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.8 mt 66.04 14.03 9.4 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.783 1.633 . . . . 0.0 112.492 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.541 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.2 mttt -69.65 -35.31 75.06 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 124.374 1.07 . . . . 0.0 110.611 175.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.2 m -126.69 152.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 O-C-N 123.907 0.754 . . . . 0.0 109.479 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 45.1 t -119.86 147.39 44.75 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.14 0.976 . . . . 0.0 108.826 176.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.6 tp -99.38 101.67 13.02 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.1 p -87.69 -34.15 18.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.677 0.791 . . . . 0.0 111.456 -175.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.436 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.7 m -139.42 161.16 58.62 Favored Pre-proline 0 N--CA 1.482 1.142 0 CA-C-O 117.21 -1.376 . . . . 0.0 107.57 176.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -25.53 -59.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 125.261 3.974 . . . . 0.0 116.606 -176.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -128.83 53.4 1.86 Allowed 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.456 0.646 . . . . 0.0 110.586 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.436 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 70.1 m -130.97 127.88 39.29 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.414 ' NE1' HD13 ' A' ' 55' ' ' LEU . 81.6 m95 -118.38 137.55 53.04 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.421 0.688 . . . . 0.0 110.468 -171.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 49.9 t -116.19 164.3 14.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.949 0.899 . . . . 0.0 109.518 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 29' ' ' THR . 40.9 tp -67.64 108.56 2.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 173.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.346 1.121 0 O-C-N 123.782 0.676 . . . . 0.0 112.533 176.713 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 . . . . . 0 N--CA 1.479 0.997 0 CA-C-O 119.056 -0.497 . . . . 0.0 110.693 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.15 -48.84 76.39 Favored Glycine 0 C--N 1.353 1.523 0 O-C-N 123.527 0.517 . . . . 0.0 114.275 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -64.98 -40.5 95.07 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.309 0.576 . . . . 0.0 110.028 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.417 HD12 HG21 ' A' ' 54' ' ' VAL . 2.9 tm? -62.0 -42.72 99.46 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.436 1.495 . . . . 0.0 110.215 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.05 -40.0 95.32 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.334 1.054 . . . . 0.0 110.398 177.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.71 -43.16 97.41 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.532 177.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.433 ' O ' HG23 ' A' ' 27' ' ' VAL . 42.8 mmm-85 -66.26 -45.4 80.69 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.564 0.746 . . . . 0.0 111.394 -177.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.522 HG21 HD21 ' A' ' 55' ' ' LEU . 75.5 mt -57.07 -45.41 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 123.952 0.782 . . . . 0.0 109.689 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.638 HD21 ' HB3' ' A' ' 63' ' ' LYS . 66.5 mt -65.0 -38.06 89.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.607 0.567 . . . . 0.0 111.169 -179.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.541 HE21 ' HG3' ' A' ' 30' ' ' GLU . 22.7 tp60 -69.42 -44.24 71.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.895 0.747 . . . . 0.0 109.983 -174.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 23' ' ' ARG . 98.5 t -58.85 -46.13 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.306 1.043 . . . . 0.0 110.793 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.39 -34.11 77.23 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.328 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -76.56 -45.28 31.22 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.815 0.446 . . . . 0.0 110.714 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.541 ' HG3' HE21 ' A' ' 26' ' ' GLN . 46.0 mt-10 -68.53 -42.12 78.91 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.923 0.489 . . . . 0.0 110.628 -175.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.18 -42.06 76.49 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.236 0.96 . . . . 0.0 111.758 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.75 28.06 71.03 Favored Glycine 0 C--N 1.35 1.346 0 O-C-N 123.61 0.568 . . . . 0.0 112.311 -176.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.7 p -161.38 154.56 17.8 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.541 1.137 . . . . 0.0 108.693 -172.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.457 ' HB3' HG21 ' A' ' 67' ' ' THR . 29.4 Cg_endo -60.86 124.35 14.78 Favored 'Trans proline' 0 C--N 1.374 1.916 0 C-N-CA 122.721 2.281 . . . . 0.0 112.426 178.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 72.8 t -105.41 128.06 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.9 mttt -68.29 150.6 48.05 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 41' ' ' VAL . 40.2 tp -56.94 -40.11 75.78 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.44 0.696 . . . . 0.0 110.071 174.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.09 -52.83 6.89 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.879 1.272 . . . . 0.0 112.227 167.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.457 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 10.2 tt0 -75.39 -25.32 57.53 Favored 'General case' 0 C--O 1.207 -1.167 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.573 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.25 -35.16 80.17 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.73 0.696 . . . . 0.0 110.525 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 37' ' ' LEU . 59.9 t -60.0 -43.03 91.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 C-N-CA 123.499 0.72 . . . . 0.0 110.082 172.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -66.82 -57.46 6.99 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.387 1.075 . . . . 0.0 111.017 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -65.37 -53.57 41.5 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.551 1.14 . . . . 0.0 112.415 -174.094 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.2 t -81.36 -12.8 58.89 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 122.732 0.413 . . . . 0.0 110.916 -175.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 67.19 13.39 9.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.3 1.44 . . . . 0.0 112.443 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -97.07 153.93 38.34 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 124.275 1.03 . . . . 0.0 111.086 -173.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.63 135.82 47.1 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.998 2.465 . . . . 0.0 112.285 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -44.51 -46.09 9.62 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.573 1.149 . . . . 0.0 113.296 174.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -60.71 -39.97 90.52 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.208 0.603 . . . . 0.0 112.134 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -66.47 -50.81 62.08 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.294 0.371 . . . . 0.0 110.521 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 36.6 mt -57.38 -57.22 13.6 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 124.168 0.918 . . . . 0.0 110.395 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.408 ' HA ' HD12 ' A' ' 55' ' ' LEU . 27.8 t-20 -51.03 -52.16 45.87 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.24 1.416 . . . . 0.0 112.097 -177.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -57.79 -46.53 84.48 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.188 0.595 . . . . 0.0 111.852 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.417 HG21 HD12 ' A' ' 20' ' ' LEU . 90.7 t -63.72 -37.55 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 O-C-N 123.297 0.373 . . . . 0.0 110.141 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.522 HD21 HG21 ' A' ' 24' ' ' ILE . 30.3 mt -58.18 -30.67 66.59 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.488 1.115 . . . . 0.0 113.147 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . 0.501 ' HA ' ' HG2' ' A' ' 59' ' ' LYS . 18.7 m-85 -75.84 -25.42 56.23 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-N 119.348 0.976 . . . . 0.0 111.808 176.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.468 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.1 tmt_? -70.11 -50.91 36.01 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 171.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 85.2 mtp -61.69 -38.82 89.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.783 1.233 . . . . 0.0 112.345 -175.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 56' ' ' TYR . 17.5 ptpt -65.56 -37.18 85.96 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 120.785 0.326 . . . . 0.0 111.185 -176.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -68.44 -30.67 69.6 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.572 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 11.7 mm-40 -80.82 0.46 34.84 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.269 0.627 . . . . 0.0 111.237 176.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 68.23 17.44 9.33 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 125.053 1.341 . . . . 0.0 111.714 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.638 ' HB3' HD21 ' A' ' 25' ' ' LEU . 99.4 mttt -77.66 -37.02 50.78 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.347 0.659 . . . . 0.0 111.702 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.72 146.94 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 CA-C-O 121.719 0.771 . . . . 0.0 111.303 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.7 m -109.29 134.05 52.28 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.968 1.307 . . . . 0.0 109.721 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -96.85 102.37 14.14 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . 0.457 HG21 ' HB3' ' A' ' 34' ' ' PRO . 9.3 t -92.91 -32.94 14.4 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.257 -171.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.772 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.7 m -139.99 158.0 68.2 Favored Pre-proline 0 N--CA 1.478 0.96 0 CA-C-O 117.23 -1.367 . . . . 0.0 108.101 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -25.57 -70.12 0.04 OUTLIER 'Trans proline' 0 C--N 1.393 2.887 1 C-N-CA 125.589 4.193 . . . . 0.0 116.323 -175.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.41 17.19 20.37 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.792 0.837 . . . . 0.0 112.275 176.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.772 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 42.2 m -109.22 128.98 55.49 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 121.345 0.593 . . . . 0.0 110.439 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.442 ' CE2' HD13 ' A' ' 55' ' ' LEU . 73.9 m95 -112.31 168.19 9.82 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.485 1.114 . . . . 0.0 109.235 -175.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 44.6 t -151.36 166.16 31.85 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.673 1.189 . . . . 0.0 108.391 178.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 42.6 tp -64.29 133.75 53.34 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.348 1.223 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 172.435 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HG3' HG22 ' A' ' 54' ' ' VAL . 44.8 tt0 . . . . . 0 N--CA 1.48 1.068 0 N-CA-C 112.619 0.6 . . . . 0.0 112.619 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -55.63 -38.16 70.66 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.242 0.339 . . . . 0.0 113.797 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.2 m170 -73.6 -36.56 65.53 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.02 0.528 . . . . 0.0 110.648 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.58 HD11 HD23 ' A' ' 51' ' ' LEU . 2.4 tm? -62.52 -45.39 93.2 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.202 1.001 . . . . 0.0 109.905 177.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.34 -44.78 88.89 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.498 1.119 . . . . 0.0 110.444 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 15.9 mm100 -60.02 -39.79 87.08 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 124.059 0.849 . . . . 0.0 111.953 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.417 ' O ' HG23 ' A' ' 27' ' ' VAL . 23.0 tpt180 -68.37 -41.71 80.22 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-O 119.64 -0.219 . . . . 0.0 110.691 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.5 mt -61.51 -47.69 92.22 Favored 'Isoleucine or valine' 0 C--N 1.358 0.956 0 O-C-N 123.316 0.385 . . . . 0.0 110.202 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.498 HD21 ' HB3' ' A' ' 63' ' ' LYS . 95.8 mt -52.69 -44.06 66.01 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.749 0.82 . . . . 0.0 111.923 174.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.15 -54.7 25.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.78 0.675 . . . . 0.0 110.768 -177.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 23' ' ' ARG . 90.5 t -56.25 -45.86 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.187 0.995 . . . . 0.0 111.434 -177.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.604 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.9 mt -64.79 -35.84 82.4 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 123.637 0.586 . . . . 0.0 111.536 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -66.45 -46.18 77.32 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.874 0.469 . . . . 0.0 111.043 176.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.53 -40.33 80.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.153 0.581 . . . . 0.0 111.184 -174.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.55 87.84 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.006 0.523 . . . . 0.0 110.318 172.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.12 37.55 94.13 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.084 -177.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.1 t -164.6 152.09 10.21 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.501 0.72 . . . . 0.0 109.682 -167.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -50.26 126.53 17.66 Favored 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 123.14 2.56 . . . . 0.0 113.177 168.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 69.0 t -118.22 128.87 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.364 1.066 . . . . 0.0 108.31 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 56.4 mtmt -65.11 150.63 47.81 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 123.366 0.416 . . . . 0.0 110.401 176.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.444 ' O ' HG23 ' A' ' 41' ' ' VAL . 22.6 tp -61.94 -46.94 87.14 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.648 0.593 . . . . 0.0 110.761 176.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.68 -31.54 26.22 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.3 tt0 -80.24 -37.0 33.9 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.668 0.387 . . . . 0.0 110.292 174.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.03 -31.85 69.2 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.619 0.767 . . . . 0.0 110.774 178.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.49 ' HA ' HD11 ' A' ' 51' ' ' LEU . 25.0 t -54.72 -54.2 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 123.512 0.507 . . . . 0.0 111.493 176.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -74.6 -44.66 49.65 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.452 0.47 . . . . 0.0 111.965 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 34.0 mm-40 -59.26 -54.87 41.93 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.3 t -75.21 -16.53 60.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.233 0.613 . . . . 0.0 111.105 -178.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 65.21 23.17 12.24 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.2 1.4 . . . . 0.0 112.253 177.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.17 151.01 45.3 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.115 0.966 . . . . 0.0 109.831 -178.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.62 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 19.9 Cg_endo -59.75 136.59 71.43 Favored 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 122.681 2.254 . . . . 0.0 111.921 174.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -47.95 -33.24 7.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.991 1.316 . . . . 0.0 113.285 176.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.62 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 14.2 ptp180 -59.78 -46.31 89.57 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.177 0.591 . . . . 0.0 111.037 177.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.481 ' HG3' ' HG ' ' A' ' 20' ' ' LEU . 10.3 tp10 -67.09 -49.96 63.22 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.98 0.912 . . . . 0.0 110.521 -178.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.58 HD23 HD11 ' A' ' 20' ' ' LEU . 48.2 mt -56.45 -54.07 50.01 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.93 -179.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -51.29 -49.51 61.12 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.084 1.353 . . . . 0.0 112.171 -176.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.352 0.709 0 O-C-N 123.88 0.738 . . . . 0.0 111.821 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.424 ' O ' ' HG3' ' A' ' 58' ' ' MET . 78.1 t -68.82 -36.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 122.545 0.338 . . . . 0.0 110.785 -176.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.4 mt -52.68 -37.88 59.56 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.319 1.048 . . . . 0.0 112.917 173.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -70.16 -31.48 68.99 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.642 0.655 . . . . 0.0 111.513 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -64.1 -52.43 59.25 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.424 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 74.9 mtp -62.02 -33.44 74.37 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 124.152 0.981 . . . . 0.0 111.336 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -62.42 -42.31 99.35 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.574 0.749 . . . . 0.0 111.908 175.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -69.52 -22.56 63.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.267 0.627 . . . . 0.0 111.273 173.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.406 ' HB3' ' HE3' ' A' ' 63' ' ' LYS . 18.6 mm-40 -89.1 -0.28 57.31 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.446 0.698 . . . . 0.0 111.309 173.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 65.48 11.17 7.19 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 125.027 1.331 . . . . 0.0 112.43 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.498 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.7 mttt -74.53 -34.82 63.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.869 0.868 . . . . 0.0 111.2 -178.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.4 m -128.9 147.07 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.229 0.612 . . . . 0.0 109.637 175.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . 0.631 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 49.0 m -121.0 156.28 32.48 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.962 0.905 . . . . 0.0 109.459 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.7 tp -104.17 103.31 13.07 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.7 t -95.68 -36.4 11.22 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.366 0.666 . . . . 0.0 111.127 -169.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.567 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.1 m -139.34 166.8 21.89 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 123.584 0.754 . . . . 0.0 109.469 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -51.06 106.92 0.15 Allowed 'Trans proline' 0 C--N 1.39 2.731 0 C-N-CA 123.177 2.585 . . . . 0.0 113.195 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 66.11 21.31 11.19 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.569 1.148 . . . . 0.0 111.933 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 29.2 m -120.14 122.75 41.71 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 123.937 0.895 . . . . 0.0 108.771 -177.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -106.99 169.01 8.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.631 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 24.6 p -150.74 158.49 44.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.604 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 18.7 tp -78.26 105.07 9.25 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.345 1.033 0 O-C-N 123.843 0.715 . . . . 0.0 111.327 176.774 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 . . . . . 0 N--CA 1.471 0.593 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -69.81 -40.27 75.47 Favored Glycine 0 C--N 1.35 1.33 0 N-CA-C 115.541 0.976 . . . . 0.0 115.541 177.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -72.89 -37.95 67.13 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.006 0.908 . . . . 0.0 110.149 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.648 HD11 HD23 ' A' ' 51' ' ' LEU . 3.0 tm? -66.15 -36.43 83.11 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 113.378 -1.737 . . . . 0.0 110.156 174.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.421 ' HG3' ' HG2' ' A' ' 58' ' ' MET . 34.6 tt0 -60.64 -46.16 91.35 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.316 1.046 . . . . 0.0 110.32 174.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 69.8 mt-30 -65.98 -32.62 74.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.438 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.503 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -66.74 -48.66 68.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.48 0.712 . . . . 0.0 109.353 176.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.437 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.2 mt -57.65 -49.17 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 124.275 0.984 . . . . 0.0 109.878 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.509 HD21 ' HB3' ' A' ' 63' ' ' LYS . 78.2 mt -55.8 -40.15 72.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 123.596 0.758 . . . . 0.0 110.832 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -70.87 -41.48 71.31 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 123.865 0.728 . . . . 0.0 110.692 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 23' ' ' ARG . 60.5 t -54.69 -46.34 73.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.298 0.639 . . . . 0.0 110.221 174.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 71.2 mt -65.26 -39.76 93.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.253 -178.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -69.58 -48.48 60.04 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.279 1.032 . . . . 0.0 112.043 -177.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.99 -36.15 81.54 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.616 0.766 . . . . 0.0 110.237 -176.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.73 87.51 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.782 171.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 24.31 70.34 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.951 -171.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -153.35 149.56 21.75 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.413 1.085 . . . . 0.0 109.36 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -55.17 114.66 1.97 Allowed 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.533 2.156 . . . . 0.0 112.277 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.449 HG21 HG12 ' A' ' 27' ' ' VAL . 91.7 t -96.04 131.5 42.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.777 0.831 . . . . 0.0 108.924 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 46.2 mtpt -73.12 151.27 41.66 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.04 0.536 . . . . 0.0 109.943 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.484 ' O ' HG23 ' A' ' 41' ' ' VAL . 36.2 tp -54.09 -44.74 71.47 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.394 1.058 . . . . 0.0 111.199 178.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.89 -49.18 11.11 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.043 0.937 . . . . 0.0 112.627 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.43 ' HA ' ' HG2' ' A' ' 42' ' ' LYS . 52.1 tt0 -77.07 -28.18 54.55 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.595 0.358 . . . . 0.0 110.807 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.14 -32.27 73.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.336 0.255 . . . . 0.0 110.358 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.553 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.2 t -59.68 -55.44 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.302 0.641 . . . . 0.0 110.786 175.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HG2' ' HA ' ' A' ' 39' ' ' GLN . 20.3 ptmt -69.9 -42.26 73.63 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.601 -174.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -72.47 -36.25 68.41 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.8 m -83.75 -17.04 42.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 117.866 0.303 . . . . 0.0 111.443 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 58.94 27.53 16.4 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.533 1.133 . . . . 0.0 111.82 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.68 154.9 54.98 Favored Pre-proline 0 C--O 1.245 0.854 0 C-N-CA 124.283 1.033 . . . . 0.0 109.963 -174.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.43 131.13 30.66 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.504 2.136 . . . . 0.0 111.864 177.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.544 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.5 ttmt -45.23 -41.05 8.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.486 1.515 . . . . 0.0 113.239 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -53.81 -49.4 68.45 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.816 0.846 . . . . 0.0 111.264 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.97 -44.25 96.56 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 123.467 0.707 . . . . 0.0 110.773 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 20' ' ' LEU . 75.1 mt -54.73 -51.07 66.78 Favored 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.513 1.133 . . . . 0.0 110.671 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.38 -54.73 23.61 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.257 0.973 . . . . 0.0 112.311 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -53.57 -44.89 69.68 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.663 HG12 ' SD ' ' A' ' 58' ' ' MET . 94.8 t -66.37 -51.1 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 122.869 0.467 . . . . 0.0 110.789 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.437 HD13 ' NE1' ' A' ' 72' ' ' TRP . 57.7 mt -48.63 -49.62 36.39 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.509 1.524 . . . . 0.0 114.537 -176.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -69.35 -29.43 67.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.451 0.301 . . . . 0.0 111.421 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -67.57 -47.76 68.86 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 174.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.663 ' SD ' HG12 ' A' ' 54' ' ' VAL . 73.2 mtp -60.58 -34.06 73.62 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.908 0.883 . . . . 0.0 110.927 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . 0.404 ' HB2' ' HZ3' ' A' ' 72' ' ' TRP . 58.2 tttm -64.78 -42.62 94.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.748 0.819 . . . . 0.0 110.82 177.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -59.91 -44.05 94.51 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.74 0.816 . . . . 0.0 110.423 172.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -78.92 -1.28 34.5 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.469 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt 62.93 15.72 8.58 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 125.343 1.457 . . . . 0.0 112.28 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.509 ' HB3' HD21 ' A' ' 25' ' ' LEU . 92.4 mttt -67.96 -33.24 74.27 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.573 1.149 . . . . 0.0 109.868 173.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 28.9 m -129.1 169.43 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.265 0.626 . . . . 0.0 109.451 173.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.9 t -134.05 147.32 50.91 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 176.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.4 tp -100.54 106.28 17.78 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 35.1 p -93.7 -34.29 13.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.636 0.774 . . . . 0.0 111.772 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.663 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 47.6 t -141.15 154.65 68.07 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -21.68 -67.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.394 2.957 1 C-N-CA 125.594 4.196 . . . . 0.0 116.513 -177.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.08 51.69 1.42 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.489 0.661 . . . . 0.0 110.538 173.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.663 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 69.3 m -131.87 128.57 38.9 Favored 'General case' 0 C--O 1.243 0.711 0 C-N-CA 123.647 0.779 . . . . 0.0 109.541 172.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.437 ' NE1' HD13 ' A' ' 55' ' ' LEU . 75.2 m95 -117.67 142.22 47.49 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.789 0.836 . . . . 0.0 109.701 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 38.7 t -115.87 166.31 12.11 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.585 0.754 . . . . 0.0 109.848 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.83 129.6 40.39 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.708 0.803 . . . . 0.0 109.428 174.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 CA--C 1.525 0.684 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 175.821 . . . . . . . . 0 0 . 1 . 015 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER . . . . . 0 N--CA 1.469 0.487 0 N-CA-C 109.67 -0.492 . . . . 0.0 109.67 . . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 22' ' ' GLN . . . -51.51 -38.22 42.44 Favored Glycine 0 C--N 1.346 1.117 0 O-C-N 123.77 0.669 . . . . 0.0 114.442 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -83.39 -32.62 26.07 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.393 0.277 . . . . 0.0 110.817 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' A' ' 51' ' ' LEU . 0.8 OUTLIER -60.35 -53.11 61.54 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.454 1.102 . . . . 0.0 108.937 178.433 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.757 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.6 tt0 -59.48 -47.46 85.41 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.551 176.011 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -60.59 -41.18 94.17 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 123.784 0.678 . . . . 0.0 109.963 -173.463 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.405 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -64.51 -49.62 70.62 Favored 'General case' 0 C--N 1.346 0.426 0 C-N-CA 123.666 0.787 . . . . 0.0 111.968 -178.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 76.1 mt -58.62 -49.52 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 124.056 0.848 . . . . 0.0 110.152 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.51 -38.76 91.18 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 123.586 0.754 . . . . 0.0 111.286 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -70.92 -41.41 71.25 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.47 0.481 . . . . 0.0 110.573 -176.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 23' ' ' ARG . 86.7 t -63.31 -37.52 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.105 0.562 . . . . 0.0 110.338 176.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.511 HD22 ' HA ' ' A' ' 73' ' ' CYS . 89.5 mt -71.09 -28.94 64.7 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.767 0.427 . . . . 0.0 111.123 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 99.0 m -73.6 -49.58 25.49 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.048 0.939 . . . . 0.0 111.632 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -66.85 -32.08 73.11 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.158 0.583 . . . . 0.0 110.572 -176.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.32 -47.73 80.98 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.918 169.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.66 27.29 69.61 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.975 0.797 . . . . 0.0 111.332 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.4 t -160.5 151.13 15.29 Favored Pre-proline 0 C--O 1.245 0.86 0 C-N-CA 124.478 1.111 . . . . 0.0 109.238 -166.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -56.52 123.83 14.78 Favored 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 122.738 2.292 . . . . 0.0 112.209 172.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 88.0 t -113.62 137.21 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.475 1.11 . . . . 0.0 108.61 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 95.1 mttt -75.1 148.56 39.62 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 123.221 0.608 . . . . 0.0 109.456 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.505 ' O ' HG23 ' A' ' 41' ' ' VAL . 45.6 tp -54.01 -43.09 69.77 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 124.544 1.152 . . . . 0.0 111.013 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -43.2 -51.06 6.25 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.502 1.121 . . . . 0.0 113.184 170.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -74.42 -30.91 62.11 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.931 0.493 . . . . 0.0 110.84 -179.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 37' ' ' LEU . 97.0 mt -61.83 -33.6 74.44 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.897 0.479 . . . . 0.0 110.192 175.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 37' ' ' LEU . 60.9 t -59.38 -55.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.609 0.764 . . . . 0.0 111.738 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -68.67 -41.98 78.52 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 123.853 0.721 . . . . 0.0 111.003 -174.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -67.81 -48.17 67.03 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.208 0.603 . . . . 0.0 112.03 -178.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 63.6 m -77.83 -13.67 59.81 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.004 0.521 . . . . 0.0 111.325 -177.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 57.69 40.57 26.39 Favored 'General case' 0 C--N 1.364 1.203 0 C-N-CA 124.253 1.021 . . . . 0.0 110.407 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.486 ' HB3' HD21 ' A' ' 51' ' ' LEU . . . -138.6 154.29 73.14 Favored Pre-proline 0 CA--C 1.553 1.075 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.599 -172.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -60.61 129.06 27.88 Favored 'Trans proline' 0 C--N 1.381 2.269 0 C-N-CA 123.198 2.598 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -41.0 -48.82 3.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.178 1.391 . . . . 0.0 114.08 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 82.1 mtm180 -59.24 -45.45 91.13 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 123.87 0.731 . . . . 0.0 111.061 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.06 -46.28 81.83 Favored 'General case' 0 C--O 1.241 0.622 0 O-C-N 123.957 0.786 . . . . 0.0 109.661 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.576 ' HA ' HD11 ' A' ' 20' ' ' LEU . 81.3 mt -56.1 -49.86 72.66 Favored 'General case' 0 C--N 1.356 0.874 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.927 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.403 ' HA ' HD12 ' A' ' 55' ' ' LEU . 22.2 t-20 -63.15 -43.4 98.42 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.385 1.053 . . . . 0.0 112.698 -173.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 78.8 mm-40 -60.97 -45.39 94.97 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 120.573 0.225 . . . . 0.0 111.058 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.5 t -66.17 -38.33 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.341 0.656 . . . . 0.0 110.705 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 52' ' ' ASN . 14.7 mt -53.1 -39.64 63.54 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.684 1.193 . . . . 0.0 112.767 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -68.03 -35.31 78.06 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 118.417 0.553 . . . . 0.0 112.033 179.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.492 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 66.1 ttp85 -68.01 -50.34 56.07 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.757 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 69.6 mtm -62.27 -28.39 69.68 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.989 0.806 . . . . 0.0 111.678 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -71.84 -38.91 70.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -63.44 -39.91 95.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.304 0.642 . . . . 0.0 110.414 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.33 -2.54 45.8 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.759 0.824 . . . . 0.0 111.436 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.1 mt 68.59 10.33 7.82 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.155 1.382 . . . . 0.0 112.529 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 64.5 mttm -64.66 -32.02 73.5 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.875 0.87 . . . . 0.0 110.416 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 18.5 m -130.62 165.37 31.1 Favored 'Isoleucine or valine' 0 C--O 1.245 0.834 0 C-N-CA 124.106 0.962 . . . . 0.0 109.115 172.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 t -143.44 145.13 32.36 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.5 tp -95.7 103.88 15.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.151 0.58 . . . . 0.0 109.546 -172.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 33.5 p -84.16 -45.62 12.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.572 0.749 . . . . 0.0 112.082 -174.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.477 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 17.8 m -132.29 169.43 13.91 Favored Pre-proline 0 N--CA 1.479 0.999 0 CA-C-O 117.44 -1.267 . . . . 0.0 107.587 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 2.3 Cg_exo -29.09 -78.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 124.689 3.593 . . . . 0.0 115.266 178.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -100.18 19.52 16.31 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 118.89 0.768 . . . . 0.0 112.026 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 20.6 m -107.97 125.85 52.01 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.134 0.492 . . . . 0.0 109.859 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.16 168.35 10.19 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.511 ' HA ' HD22 ' A' ' 28' ' ' LEU . 35.4 t -149.06 164.41 34.72 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 40.1 tp -65.98 143.82 57.14 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.529 0.518 . . . . 0.0 109.724 175.898 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.344 0.993 0 O-C-N 123.649 0.593 . . . . 0.0 113.249 178.691 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 . . . . . 0 N--CA 1.489 1.486 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . 0.439 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -66.3 -27.59 73.13 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-O 120.145 -0.253 . . . . 0.0 113.315 177.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -73.76 -35.15 64.97 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.637 0.775 . . . . 0.0 109.163 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.5 HD12 HG21 ' A' ' 54' ' ' VAL . 2.8 tm? -66.88 -39.36 87.46 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.784 1.634 . . . . 0.0 108.978 176.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -66.71 -38.44 86.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.965 0.906 . . . . 0.0 110.202 177.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 56.0 mt-30 -62.69 -40.19 96.33 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.879 0.872 . . . . 0.0 110.455 174.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -68.52 -42.87 77.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 123.614 0.766 . . . . 0.0 111.599 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.1 mt -58.89 -52.3 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 123.827 0.705 . . . . 0.0 109.361 177.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.643 HD21 ' HB3' ' A' ' 63' ' ' LYS . 91.5 mt -58.27 -40.47 81.95 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.493 0.717 . . . . 0.0 111.367 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -67.48 -49.07 65.18 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.468 0.707 . . . . 0.0 111.092 -177.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.44 -39.49 79.29 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.534 1.134 . . . . 0.0 111.349 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 73' ' ' CYS . 85.7 mt -67.89 -40.02 83.58 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.875 0.87 . . . . 0.0 110.915 176.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -68.48 -48.83 63.46 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.999 0.919 . . . . 0.0 111.426 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -71.42 -39.51 71.03 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 123.182 0.593 . . . . 0.0 110.95 -173.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.6 -33.63 75.38 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.505 0.503 . . . . 0.0 111.059 173.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.36 32.52 84.47 Favored Glycine 0 C--N 1.354 1.542 0 O-C-N 123.959 0.787 . . . . 0.0 112.771 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 p -170.31 155.86 5.31 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 124.192 0.997 . . . . 0.0 109.141 -171.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.561 ' HB3' ' HB2' ' A' ' 73' ' ' CYS . 20.2 Cg_endo -60.92 118.26 5.11 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.728 2.285 . . . . 0.0 112.998 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.79 135.66 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -66.11 143.75 57.12 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.511 0.724 . . . . 0.0 109.986 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.51 HD13 HD11 ' A' ' 55' ' ' LEU . 13.1 tp -61.26 -41.77 97.49 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.912 0.885 . . . . 0.0 110.67 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.5 -41.91 10.13 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.094 0.957 . . . . 0.0 113.42 167.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.544 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 27.4 tt0 -82.89 -29.45 29.27 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.1 mt -60.05 -34.63 73.67 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.423 ' HA ' HD11 ' A' ' 51' ' ' LEU . 91.5 t -51.8 -56.32 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 124.708 1.203 . . . . 0.0 111.701 175.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -71.53 -37.51 71.17 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.181 -173.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 9.1 mm-40 -61.38 -53.11 60.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.03 0.532 . . . . 0.0 111.704 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 46' ' ' ALA . 30.4 p -83.93 -10.32 58.05 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.113 0.565 . . . . 0.0 111.127 -176.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 63.67 17.59 10.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.623 1.169 . . . . 0.0 111.797 -178.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.528 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -107.98 151.84 41.45 Favored Pre-proline 0 N--CA 1.476 0.828 0 C-N-CA 124.134 0.974 . . . . 0.0 110.867 -175.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.3 140.24 81.82 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.548 2.165 . . . . 0.0 111.575 175.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -47.1 -34.32 5.88 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 124.19 0.996 . . . . 0.0 112.553 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . 0.44 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 20.4 tpp180 -61.82 -47.38 85.33 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.241 0.616 . . . . 0.0 111.779 177.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -62.66 -47.31 84.26 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 123.326 0.65 . . . . 0.0 110.249 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.492 ' HA ' HD11 ' A' ' 20' ' ' LEU . 17.3 mt -53.34 -56.46 16.53 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 124.62 1.168 . . . . 0.0 110.893 176.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -49.21 -52.53 26.31 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 126.091 1.757 . . . . 0.0 111.868 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 14.3 mm100 -53.42 -47.99 69.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.945 0.898 . . . . 0.0 111.667 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.5 HG21 HD12 ' A' ' 20' ' ' LEU . 85.1 t -68.32 -44.89 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.25 -179.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.51 HD11 HD13 ' A' ' 37' ' ' LEU . 54.6 mt -52.32 -44.51 65.14 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.496 1.518 . . . . 0.0 114.306 -177.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -62.89 -32.45 73.71 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.202 0.456 . . . . 0.0 111.071 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.46 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.5 mmm-85 -70.68 -49.17 50.09 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 123.03 0.532 . . . . 0.0 109.768 177.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 70.7 mtp -57.77 -36.12 71.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.114 0.966 . . . . 0.0 111.618 -177.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -59.4 -44.04 92.87 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.427 0.691 . . . . 0.0 110.246 176.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -75.29 -25.33 57.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.502 1.121 . . . . 0.0 111.81 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 7.0 mm-40 -77.83 -4.65 47.63 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.041 0.536 . . . . 0.0 110.001 170.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 83.1 mt 68.32 19.19 9.04 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 125.541 1.536 . . . . 0.0 111.438 178.45 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.643 ' HB3' HD21 ' A' ' 25' ' ' LEU . 98.8 mttt -80.72 -33.42 35.26 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.782 1.233 . . . . 0.0 111.711 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.9 m -132.74 161.75 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-O 121.267 0.556 . . . . 0.0 111.189 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.6 t -132.31 145.34 51.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.904 1.281 . . . . 0.0 108.61 174.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 47.0 tp -95.67 109.01 21.35 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 37.3 p -84.78 -44.57 13.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.161 0.584 . . . . 0.0 111.168 -175.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.644 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 13.1 m -134.72 159.5 71.93 Favored Pre-proline 0 CA--C 1.555 1.141 0 CA-C-O 117.212 -1.375 . . . . 0.0 107.64 -175.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -29.68 -66.02 0.07 OUTLIER 'Trans proline' 0 C--N 1.396 3.059 0 C-N-CA 125.017 3.811 . . . . 0.0 116.243 -174.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.65 40.07 3.02 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.924 0.889 . . . . 0.0 111.084 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.644 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 91.1 m -131.2 122.82 27.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.606 0.762 . . . . 0.0 109.869 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.5 m95 -114.25 151.47 32.79 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.119 0.968 . . . . 0.0 108.698 -172.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.561 ' HB2' ' HB3' ' A' ' 34' ' ' PRO . 42.7 t -132.54 170.26 15.41 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.053 0.941 . . . . 0.0 109.209 177.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.0 tp -68.49 160.31 30.06 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 N--CA 1.476 1.313 0 C-N-CA 122.74 0.209 . . . . 0.0 112.722 179.512 . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 . . . . . 0 N--CA 1.478 0.934 0 CA-C-O 121.065 0.46 . . . . 0.0 109.784 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.72 -30.27 72.74 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.643 -1.162 . . . . 0.0 113.458 179.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -74.68 -39.1 62.2 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.475 HD12 HG21 ' A' ' 54' ' ' VAL . 2.4 tm? -65.11 -40.87 95.15 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.444 1.098 . . . . 0.0 110.403 173.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.739 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 19.5 tt0 -58.28 -49.97 75.26 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.313 1.445 . . . . 0.0 110.974 175.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -66.32 -31.6 72.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.916 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.422 ' O ' HG23 ' A' ' 27' ' ' VAL . 20.6 tpp180 -62.74 -47.15 84.82 Favored 'General case' 0 C--N 1.351 0.637 0 C-N-CA 122.944 0.498 . . . . 0.0 110.553 174.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 20' ' ' LEU . 68.6 mt -60.09 -46.94 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.859 0.725 . . . . 0.0 109.9 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.487 HD11 ' HD3' ' A' ' 63' ' ' LYS . 93.2 mt -62.16 -35.89 80.17 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.547 0.739 . . . . 0.0 110.97 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 29.8 tt0 -70.28 -44.66 67.94 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.885 0.741 . . . . 0.0 110.567 178.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 23' ' ' ARG . 55.8 t -54.23 -44.59 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.979 0.912 . . . . 0.0 110.938 174.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.9 mt -66.26 -37.45 85.51 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -64.22 -51.16 65.01 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.167 0.987 . . . . 0.0 111.605 177.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 15.7 mm-40 -63.29 -46.6 86.0 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.223 0.609 . . . . 0.0 111.444 -173.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.95 -38.29 90.46 Favored 'General case' 0 C--O 1.24 0.578 0 O-C-N 124.177 0.923 . . . . 0.0 110.573 178.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.57 -56.8 4.91 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.142 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.1 p -72.58 161.92 76.72 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 124.12 0.968 . . . . 0.0 110.835 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -50.41 142.59 29.5 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.982 2.455 . . . . 0.0 113.368 172.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 39.6 t -121.79 132.1 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.731 0.812 . . . . 0.0 109.426 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -69.96 148.42 48.94 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.04 0.536 . . . . 0.0 109.806 176.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HG ' ' HG3' ' A' ' 48' ' ' LYS . 38.7 tp -60.78 -45.26 95.05 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.679 1.192 . . . . 0.0 110.494 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.63 -37.66 18.82 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.334 1.054 . . . . 0.0 113.509 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -82.48 -28.84 30.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.64 0.376 . . . . 0.0 110.908 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 37' ' ' LEU . 94.3 mt -60.55 -32.36 71.43 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 122.458 0.303 . . . . 0.0 110.219 174.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 37' ' ' LEU . 27.8 t -56.59 -56.21 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 123.945 0.898 . . . . 0.0 111.789 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -64.22 -47.08 81.08 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.591 0.557 . . . . 0.0 110.961 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.74 -48.11 82.17 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.453 0.701 . . . . 0.0 112.788 -178.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 64.4 m -82.67 -12.29 57.73 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.663 0.385 . . . . 0.0 111.971 -176.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 57.23 31.4 20.0 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.779 0.832 . . . . 0.0 111.866 -179.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . 0.424 ' HB3' HD21 ' A' ' 51' ' ' LEU . . . -125.14 154.61 71.68 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.727 -174.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . 0.462 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 31.1 Cg_endo -62.22 132.31 38.28 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 121.851 1.701 . . . . 0.0 110.961 175.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG3' ' HG ' ' A' ' 37' ' ' LEU . 40.5 ttmt -40.01 -43.99 1.66 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.976 1.31 . . . . 0.0 113.42 174.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -58.48 -42.3 87.2 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.182 0.993 . . . . 0.0 112.125 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . 0.462 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 10.0 tp10 -64.64 -50.18 68.12 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.698 0.799 . . . . 0.0 109.831 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.424 HD21 ' HB3' ' A' ' 46' ' ' ALA . 51.8 mt -59.42 -54.62 44.59 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.211 1.005 . . . . 0.0 111.503 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . 0.51 ' HA ' HD12 ' A' ' 55' ' ' LEU . 58.2 t30 -50.87 -51.2 53.91 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.282 1.833 . . . . 0.0 112.072 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.6 -43.55 98.52 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 123.729 0.643 . . . . 0.0 111.332 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.475 HG21 HD12 ' A' ' 20' ' ' LEU . 83.1 t -65.54 -35.61 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 52' ' ' ASN . 30.9 mt -56.94 -37.54 71.66 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.105 0.962 . . . . 0.0 112.82 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -70.03 -33.43 71.97 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.766 0.712 . . . . 0.0 111.085 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -70.72 -48.25 55.57 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.739 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 74.9 mtm -64.4 -29.11 70.18 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.857 0.863 . . . . 0.0 111.679 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -63.45 -40.98 98.6 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.053 0.541 . . . . 0.0 110.562 175.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -71.46 -25.3 62.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.283 0.633 . . . . 0.0 111.135 176.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -85.0 -2.53 58.07 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.283 0.633 . . . . 0.0 111.647 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 66.58 17.1 10.57 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.922 1.289 . . . . 0.0 112.469 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.552 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 96.6 mttt -73.2 -38.61 66.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.043 0.937 . . . . 0.0 110.99 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.438 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 18.6 m -127.1 164.41 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.451 0.7 . . . . 0.0 110.14 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.5 m -144.91 151.66 39.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.0 tp -96.03 101.61 13.29 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.6 p -84.69 -41.78 15.93 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.544 0.738 . . . . 0.0 111.557 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.435 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 49.1 m -134.93 167.77 21.12 Favored Pre-proline 0 N--CA 1.481 1.124 0 C-N-CA 123.751 0.82 . . . . 0.0 109.64 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.98 110.78 0.41 Allowed 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 122.976 2.451 . . . . 0.0 112.867 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.8 33.73 17.6 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.982 1.313 . . . . 0.0 111.56 -178.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.435 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 51.0 m -129.67 121.76 27.62 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -118.45 142.47 47.53 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.275 1.03 . . . . 0.0 108.315 -174.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 33.7 t -130.4 165.74 21.94 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 30.2 tp -74.61 102.53 4.6 Favored 'General case' 0 C--O 1.24 0.584 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.0 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.438 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . . . . . . 0 C--N 1.34 0.794 0 O-C-N 123.896 0.748 . . . . 0.0 111.524 -178.313 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 . . . . . 0 N--CA 1.483 1.19 0 CA-C-O 120.429 0.156 . . . . 0.0 111.027 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.9 -44.2 89.55 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 124.045 0.841 . . . . 0.0 114.762 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -70.67 -39.6 73.48 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.929 0.864 . . . . 0.0 110.972 -175.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.445 ' O ' HG13 ' A' ' 24' ' ' ILE . 2.4 tm? -64.98 -40.29 94.75 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.348 0.659 . . . . 0.0 110.1 174.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -58.66 -47.76 83.37 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.295 1.038 . . . . 0.0 111.395 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -36.88 82.8 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.039 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.427 ' O ' HG23 ' A' ' 27' ' ' VAL . 16.4 tpt180 -67.41 -41.63 84.56 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.083 0.553 . . . . 0.0 111.011 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.474 HG21 HD21 ' A' ' 55' ' ' LEU . 79.4 mt -60.28 -52.93 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 122.836 0.454 . . . . 0.0 110.432 176.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.18 -32.68 72.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.503 0.721 . . . . 0.0 111.09 -178.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -63.55 -52.13 62.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.354 1.061 . . . . 0.0 109.926 176.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 23' ' ' ARG . 76.1 t -58.2 -41.86 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.966 0.906 . . . . 0.0 110.591 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.479 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 97.5 mt -69.88 -36.0 75.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.302 0.641 . . . . 0.0 111.695 -177.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -70.44 -45.04 66.61 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.359 0.663 . . . . 0.0 111.861 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -71.81 -33.42 68.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.948 0.499 . . . . 0.0 111.326 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.79 68.98 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 168.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.84 26.53 67.2 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.643 -175.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.1 t -152.53 150.6 25.3 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.262 1.025 . . . . 0.0 109.028 -171.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.19 125.11 15.49 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.675 2.25 . . . . 0.0 113.32 173.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.94 132.8 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.143 0.977 . . . . 0.0 108.521 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 54.7 mtpt -64.35 151.7 43.24 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.492 0.717 . . . . 0.0 111.19 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.416 ' O ' HG23 ' A' ' 41' ' ' VAL . 51.9 tp -62.4 -50.51 71.26 Favored 'General case' 0 C--N 1.356 0.855 0 O-C-N 123.424 0.452 . . . . 0.0 109.852 176.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.03 -37.95 10.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.99 0.916 . . . . 0.0 112.848 170.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 61.6 tt0 -78.31 -34.66 48.57 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.253 0.621 . . . . 0.0 110.619 -179.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 66.9 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.601 0.761 . . . . 0.0 110.815 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 37' ' ' LEU . 35.8 t -55.49 -50.88 63.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.37 0.668 . . . . 0.0 111.706 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -76.26 -43.62 41.05 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.986 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -59.59 -56.51 20.96 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.274 0.488 . . . . 0.0 112.039 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 62.7 m -72.74 -8.39 55.16 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.827 0.451 . . . . 0.0 111.632 -177.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 61.9 22.87 13.37 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.017 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.84 149.01 58.35 Favored Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.92 -164.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.47 133.14 29.2 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.508 2.139 . . . . 0.0 111.761 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -42.15 -36.14 1.11 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.734 1.613 . . . . 0.0 112.934 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.9 ttm105 -54.6 -56.62 17.09 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.355 1.062 . . . . 0.0 112.21 176.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -44.75 79.53 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.873 -176.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.7 mt -55.37 -59.71 4.43 Favored 'General case' 0 C--O 1.212 -0.881 0 O-C-N 124.082 0.864 . . . . 0.0 111.093 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -48.4 -56.12 9.01 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.278 1.431 . . . . 0.0 112.089 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.33 -52.61 64.63 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.779 0.832 . . . . 0.0 112.101 -177.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.544 HG12 ' SD ' ' A' ' 58' ' ' MET . 97.4 t -67.05 -38.0 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 122.821 0.448 . . . . 0.0 110.204 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.474 HD21 HG21 ' A' ' 24' ' ' ILE . 17.4 mt -54.06 -40.38 67.1 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.685 1.194 . . . . 0.0 114.137 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -71.76 -24.32 61.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 119.436 1.016 . . . . 0.0 111.365 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -73.61 -48.82 29.76 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.544 ' SD ' HG12 ' A' ' 54' ' ' VAL . 66.0 mtp -60.68 -37.74 82.64 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.603 1.161 . . . . 0.0 111.476 179.3 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -58.51 -45.97 87.69 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.424 1.09 . . . . 0.0 110.599 175.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . 0.43 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 4.3 ttmp? -72.77 -26.45 61.54 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.096 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -85.52 -2.17 57.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.831 0.852 . . . . 0.0 111.265 174.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 69.95 12.17 7.81 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.978 1.311 . . . . 0.0 112.306 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 94.4 mttt -70.03 -37.13 75.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.726 0.81 . . . . 0.0 110.792 175.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 22.2 m -131.25 175.77 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.3 t -144.13 158.13 43.9 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 30.5 tp -109.56 113.16 25.72 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 175.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.6 p -100.47 -31.95 11.04 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.572 0.749 . . . . 0.0 111.283 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.684 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 39.2 t -139.23 148.37 56.82 Favored Pre-proline 0 CA--C 1.552 1.035 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -26.0 -72.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.39 2.739 1 C-N-CA 125.407 4.071 . . . . 0.0 116.721 -172.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.84 39.34 2.4 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.345 0.658 . . . . 0.0 111.008 177.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.684 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 86.2 m -131.27 123.02 27.48 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.801 0.84 . . . . 0.0 109.239 176.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -104.51 160.34 15.01 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.622 -173.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 51.8 t -138.63 156.17 47.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . 0.479 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 35.7 tp -76.21 131.03 39.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.393 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . . . . . . 0 C--N 1.343 0.924 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 178.377 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 . . . . . 0 N--CA 1.476 0.836 0 N-CA-C 110.517 -0.179 . . . . 0.0 110.517 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.05 -32.06 81.31 Favored Glycine 0 C--N 1.342 0.865 0 O-C-N 123.5 0.5 . . . . 0.0 113.369 174.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -65.58 -45.28 83.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.439 0.638 . . . . 0.0 109.403 176.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.599 HD12 HG21 ' A' ' 54' ' ' VAL . 2.3 tm? -67.4 -37.63 83.4 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 113.943 -1.481 . . . . 0.0 111.404 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -65.18 -43.19 92.48 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.015 0.926 . . . . 0.0 110.709 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -66.9 -34.42 77.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.753 175.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.524 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -59.48 -52.7 64.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.234 0.614 . . . . 0.0 110.791 174.185 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.475 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.3 mt -55.57 -48.81 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 O-C-N 124.251 0.969 . . . . 0.0 110.449 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.571 HD21 ' HB3' ' A' ' 63' ' ' LYS . 89.0 mt -62.56 -37.14 84.99 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.217 0.607 . . . . 0.0 111.568 -178.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -66.74 -47.92 70.77 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.743 0.652 . . . . 0.0 110.465 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 23' ' ' ARG . 85.2 t -56.79 -40.49 71.1 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.153 0.981 . . . . 0.0 110.885 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 93.4 mt -69.47 -38.82 77.88 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.069 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.2 m -69.37 -45.97 68.07 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.546 0.738 . . . . 0.0 111.677 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -68.88 -34.83 76.08 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.437 0.695 . . . . 0.0 110.613 -176.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.76 83.23 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.7 171.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.7 28.89 68.76 Favored Glycine 0 C--N 1.352 1.429 0 O-C-N 123.946 0.779 . . . . 0.0 111.853 -171.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.5 t -162.19 147.51 10.13 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.41 1.084 . . . . 0.0 109.057 -165.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . 0.401 ' HG3' ' HB2' ' A' ' 73' ' ' CYS . 74.3 Cg_exo -51.86 114.77 1.75 Allowed 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 123.163 2.575 . . . . 0.0 113.757 174.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . 0.403 HG21 HG12 ' A' ' 27' ' ' VAL . 90.1 t -96.37 146.75 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.056 0.942 . . . . 0.0 109.691 179.214 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -82.01 152.56 26.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.505 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.45 ' HA ' HD12 ' A' ' 40' ' ' LEU . 39.1 tp -57.61 -49.46 76.35 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.517 1.127 . . . . 0.0 111.053 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.66 -32.58 42.9 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -83.88 -27.48 28.62 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.959 0.409 . . . . 0.0 110.199 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 37' ' ' LEU . 91.6 mt -65.64 -28.65 69.26 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.581 0.753 . . . . 0.0 110.504 174.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.582 ' HA ' HD11 ' A' ' 51' ' ' LEU . 91.8 t -56.21 -52.3 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.004 0.522 . . . . 0.0 111.926 -178.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -71.5 -50.73 28.65 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 123.561 0.538 . . . . 0.0 111.166 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.9 -49.38 46.44 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 123.492 0.717 . . . . 0.0 111.391 -172.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . 0.489 ' HA ' ' HB3' ' A' ' 23' ' ' ARG . 54.6 m -76.46 -11.7 59.92 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.511 0.324 . . . . 0.0 111.276 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 62.85 51.3 3.01 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.266 1.026 . . . . 0.0 111.644 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -149.74 152.06 33.97 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 123.007 0.523 . . . . 0.0 110.652 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.83 145.92 94.85 Favored 'Trans proline' 0 C--N 1.366 1.5 0 C-N-CA 122.496 2.131 . . . . 0.0 111.727 173.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -39.44 -56.58 1.58 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.87 1.268 . . . . 0.0 113.735 177.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -58.11 -36.37 72.8 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.94 -48.3 74.57 Favored 'General case' 0 C--O 1.245 0.853 0 O-C-N 123.54 0.525 . . . . 0.0 109.978 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.582 HD11 ' HA ' ' A' ' 41' ' ' VAL . 57.3 mt -55.35 -53.25 58.49 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 124.521 1.138 . . . . 0.0 111.52 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -49.76 -50.1 45.82 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 124.383 1.052 . . . . 0.0 112.285 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -56.79 -46.52 81.5 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 124.313 1.008 . . . . 0.0 111.067 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.599 HG21 HD12 ' A' ' 20' ' ' LEU . 54.0 t -70.32 -43.16 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.877 0.471 . . . . 0.0 110.835 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . 0.407 HD13 ' NE1' ' A' ' 72' ' ' TRP . 60.8 mt -51.9 -49.67 62.57 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.03 1.332 . . . . 0.0 114.078 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -71.69 -26.31 62.46 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 118.08 0.4 . . . . 0.0 110.927 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.8 tmt_? -68.43 -52.28 34.52 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.479 0.711 . . . . 0.0 109.431 174.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.504 ' SD ' HG12 ' A' ' 54' ' ' VAL . 83.3 mtp -61.11 -29.25 69.65 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.695 1.198 . . . . 0.0 111.498 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -63.78 -41.96 97.86 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.944 0.497 . . . . 0.0 110.575 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -71.49 -28.55 64.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 123.83 0.706 . . . . 0.0 110.758 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.01 -2.65 45.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.125 0.57 . . . . 0.0 110.921 173.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 74.4 mt 63.88 16.11 9.6 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.036 1.334 . . . . 0.0 112.115 178.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.571 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.9 mttt -77.06 -32.46 56.85 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.257 1.023 . . . . 0.0 110.637 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.405 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 22.0 m -129.51 164.18 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 26.7 t -137.11 148.25 46.56 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.0 tp -100.57 106.58 18.1 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 11.6 p -88.18 -43.97 11.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.902 0.881 . . . . 0.0 111.063 -176.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 34.3 t -140.73 153.71 68.14 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -177.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.02 112.75 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.528 0 C-N-CA 123.235 2.623 . . . . 0.0 114.608 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 68.73 20.41 8.17 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.856 1.262 . . . . 0.0 112.075 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 6.2 m -126.04 115.48 19.93 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . 0.407 ' NE1' HD13 ' A' ' 55' ' ' LEU . 82.5 m95 -115.99 142.98 46.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.712 0.805 . . . . 0.0 109.797 -167.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . 0.401 ' HB2' ' HG3' ' A' ' 34' ' ' PRO . 53.4 t -113.94 161.47 17.6 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 123.223 0.609 . . . . 0.0 110.213 177.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.58 102.38 0.9 Allowed 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.405 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . . . . . . 0 C--N 1.343 0.924 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.647 -178.589 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 . . . . . 0 N--CA 1.483 1.18 0 CA-C-O 119.477 -0.297 . . . . 0.0 110.852 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild core ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.62 -32.82 61.29 Favored Glycine 0 C--N 1.347 1.174 0 O-C-N 124.262 0.976 . . . . 0.0 114.275 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -67.47 -51.97 44.91 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.818 0.447 . . . . 0.0 110.555 176.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 20' ' ' LEU . . . . . 0.575 HD11 HD23 ' A' ' 51' ' ' LEU . 2.7 tm? -63.44 -37.18 86.29 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.996 1.319 . . . . 0.0 110.652 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 21' ' ' GLU . . . . . 0.749 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 29.3 tt0 -56.56 -48.72 76.73 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.537 1.135 . . . . 0.0 110.305 171.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -62.84 -38.88 92.54 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.152 -177.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 23' ' ' ARG . . . . . 0.504 ' O ' HG23 ' A' ' 27' ' ' VAL . 26.8 mmt180 -64.96 -51.91 59.18 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 122.764 0.425 . . . . 0.0 111.477 178.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 24' ' ' ILE . . . . . 0.47 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 61.6 mt -57.35 -47.85 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 O-C-N 123.865 0.728 . . . . 0.0 110.514 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 25' ' ' LEU . . . . . 0.458 HD21 ' HB3' ' A' ' 63' ' ' LYS . 94.3 mt -65.55 -32.95 74.81 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.189 0.596 . . . . 0.0 111.422 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -69.94 -43.02 72.44 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.497 0.498 . . . . 0.0 110.102 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 27' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 23' ' ' ARG . 87.8 t -56.57 -43.5 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.684 0.794 . . . . 0.0 110.748 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 28' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 79.9 mt -66.56 -42.82 86.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.293 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.5 m -72.85 -38.17 67.17 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.187 0.995 . . . . 0.0 111.91 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.51 -42.65 74.43 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.751 0.42 . . . . 0.0 110.644 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.99 -36.94 83.28 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.722 0.639 . . . . 0.0 110.862 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 59.11 34.12 77.93 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 124.155 0.909 . . . . 0.0 112.508 -174.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.9 t -164.29 151.56 10.25 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.459 1.104 . . . . 0.0 108.615 -166.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.59 118.87 5.56 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.366 2.711 . . . . 0.0 112.607 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 46.6 t -102.96 127.58 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -68.95 150.49 47.66 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.421 0.689 . . . . 0.0 110.709 -178.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 37' ' ' LEU . . . . . 0.531 HD21 ' HG3' ' A' ' 48' ' ' LYS . 57.6 tp -58.58 -46.78 86.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.076 0.95 . . . . 0.0 111.373 -179.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.86 -35.93 46.67 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.937 0.895 . . . . 0.0 113.269 171.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.33 -34.13 48.78 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.9 mt -64.18 -33.42 75.74 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.954 0.902 . . . . 0.0 110.728 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 41' ' ' VAL . . . . . 0.582 ' HA ' HD11 ' A' ' 51' ' ' LEU . 83.4 t -58.91 -47.74 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 123.318 0.647 . . . . 0.0 110.259 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -67.4 -54.04 23.94 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.28 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -70.29 -48.95 54.36 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.803 0.841 . . . . 0.0 112.867 -171.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 44.3 m -77.31 -16.06 59.12 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 62.74 56.28 1.96 Allowed 'General case' 0 C--N 1.364 1.215 0 C-N-CA 124.295 1.038 . . . . 0.0 110.574 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.43 151.32 36.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.105 -173.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -59.54 137.61 78.74 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.834 2.356 . . . . 0.0 111.969 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HG3' HD21 ' A' ' 37' ' ' LEU . 22.7 ttmm -35.1 -48.35 0.42 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.595 1.558 . . . . 0.0 112.945 169.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -61.33 -48.34 81.8 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 111.82 -178.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.9 -46.72 86.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.287 0.635 . . . . 0.0 110.164 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 51' ' ' LEU . . . . . 0.582 HD11 ' HA ' ' A' ' 41' ' ' VAL . 83.6 mt -52.79 -53.71 44.43 Favored 'General case' 0 C--O 1.206 -1.204 0 O-C-N 124.353 1.033 . . . . 0.0 110.735 174.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -59.21 -46.37 88.64 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.582 1.177 . . . . 0.0 112.766 -175.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.61 -43.21 72.0 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.428 0.455 . . . . 0.0 111.254 176.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 54' ' ' VAL . . . . . 0.458 HG21 HD12 ' A' ' 20' ' ' LEU . 50.7 t -72.79 -39.35 59.45 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.987 176.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.2 -53.88 53.24 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.781 1.232 . . . . 0.0 114.232 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -69.84 -26.31 64.16 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 119.557 1.071 . . . . 0.0 110.49 -176.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -65.03 -53.26 48.81 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.037 0.935 . . . . 0.0 109.387 171.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 58' ' ' MET . . . . . 0.749 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 73.3 mtm -64.04 -26.92 68.78 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.51 1.124 . . . . 0.0 111.906 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -66.86 -41.1 87.86 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.564 0.746 . . . . 0.0 110.347 176.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -63.45 -40.33 96.85 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.477 0.711 . . . . 0.0 109.939 172.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.77 0.65 22.9 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.852 0.861 . . . . 0.0 111.944 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.8 mt 67.96 10.45 7.81 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 125.881 1.672 . . . . 0.0 113.298 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 63' ' ' LYS . . . . . 0.566 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 55.0 mttm -69.24 -44.12 72.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.479 1.112 . . . . 0.0 110.533 177.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 64' ' ' VAL . . . . . 0.436 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 26.8 m -123.32 164.41 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.657 0.783 . . . . 0.0 109.778 -178.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.2 t -147.03 157.64 43.68 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.723 0.809 . . . . 0.0 109.034 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 66' ' ' LEU . . . . . 0.403 HD12 ' O ' ' A' ' 71' ' ' THR . 30.8 tp -101.5 106.89 18.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -178.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.2 p -86.08 -40.39 15.77 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.237 0.615 . . . . 0.0 110.748 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 68' ' ' SER . . . . . 0.437 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 16.0 p -142.21 160.65 54.15 Favored Pre-proline 0 CA--C 1.558 1.285 0 CA-C-O 117.753 -1.118 . . . . 0.0 108.357 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 37.2 Cg_exo -22.97 -70.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.393 2.892 1 C-N-CA 126.099 4.533 . . . . 0.0 117.79 -168.426 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild core ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.34 42.08 2.49 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.637 0.775 . . . . 0.0 110.506 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 71' ' ' THR . . . . . 0.403 ' O ' HD12 ' A' ' 66' ' ' LEU . 59.3 m -130.16 125.95 36.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.677 0.791 . . . . 0.0 109.92 -177.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild core ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -115.5 136.06 53.46 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.652 0.781 . . . . 0.0 109.259 -174.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 32.3 t -118.31 171.52 8.08 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.0 tp -68.83 104.75 2.13 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 173.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild core ' A' A ' 75' ' ' GLY . . . . . 0.436 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . . . . . . 0 C--N 1.348 1.215 0 O-C-N 123.946 0.779 . . . . 0.0 111.379 -178.212 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 69.3 mtm . . . . . 0 N--CA 1.48 1.031 0 N-CA-C 109.954 -0.387 . . . . 0.0 109.954 . . . . . . . . . 0 0 . 1 . 001 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 75.68 -64.18 2.62 Favored Glycine 0 N--CA 1.482 1.715 0 C-N-CA 123.541 0.591 . . . . 0.0 113.52 177.232 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 2.2 p-80 -55.41 -15.74 2.94 Favored 'General case' 0 N--CA 1.488 1.471 0 C-N-CA 125.634 1.574 . . . . 0.0 114.338 178.943 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 49.8 t-80 -69.53 -20.08 63.69 Favored 'General case' 0 N--CA 1.488 1.473 0 N-CA-C 112.044 0.387 . . . . 0.0 112.044 -178.831 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 53.8 m-70 -65.35 -19.39 65.93 Favored 'General case' 0 N--CA 1.483 1.179 0 C-N-CA 122.621 0.368 . . . . 0.0 111.068 175.076 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -85.83 142.49 28.88 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.565 0.746 . . . . 0.0 109.898 174.575 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 70.0 m-70 -98.71 -157.71 0.62 Allowed 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 123.864 0.866 . . . . 0.0 110.212 179.647 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 42.8 t-80 -91.74 30.06 1.43 Allowed 'General case' 0 CA--C 1.561 1.397 0 C-N-CA 124.892 1.277 . . . . 0.0 111.306 -177.316 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.53 ' HB2' ' NH1' ' A' ' 16' ' ' ARG . 10.2 m 60.13 82.59 0.15 Allowed 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 124.414 1.086 . . . . 0.0 109.489 -173.548 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.6 t60 -70.4 -37.59 74.5 Favored 'General case' 0 N--CA 1.48 1.039 0 C-N-CA 124.774 1.23 . . . . 0.0 111.284 -170.205 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 17.8 mmt -77.2 171.74 14.35 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.845 0.858 . . . . 0.0 110.611 -178.864 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -76.7 78.98 3.34 Favored 'General case' 0 N--CA 1.475 0.823 0 C-N-CA 123.607 0.763 . . . . 0.0 109.721 176.619 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.433 ' HA ' ' HD3' ' A' ' 14' ' ' PRO . 31.8 t70 -66.18 119.76 64.45 Favored Pre-proline 0 CA--C 1.553 1.088 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.546 -176.235 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . 0.433 ' HD3' ' HA ' ' A' ' 13' ' ' ASP . 3.5 Cg_exo -78.14 51.93 3.87 Favored 'Trans proline' 0 C--N 1.386 2.52 0 C-N-CA 124.045 3.163 . . . . 0.0 113.627 -176.364 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 148.43 72.83 0.01 OUTLIER Glycine 0 C--N 1.338 0.67 0 N-CA-C 111.398 -0.681 . . . . 0.0 111.398 176.956 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.53 ' NH1' ' HB2' ' A' ' 9' ' ' SER . 9.4 tpp180 -56.95 -38.09 72.45 Favored 'General case' 0 N--CA 1.478 0.95 0 C-N-CA 124.112 0.965 . . . . 0.0 112.079 -173.449 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -67.88 -35.13 77.97 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 123.252 0.621 . . . . 0.0 111.211 179.585 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.421 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -62.93 -44.44 97.4 Favored Glycine 0 C--N 1.352 1.453 0 CA-C-O 119.446 -0.641 . . . . 0.0 112.855 171.295 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 4.5 t60 -66.87 -42.9 84.85 Favored 'General case' 0 N--CA 1.487 1.421 0 CA-C-O 121.51 0.671 . . . . 0.0 109.745 -177.64 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.457 HD11 HD23 ' A' ' 51' ' ' LEU . 2.0 tm? -62.42 -41.41 98.68 Favored 'General case' 0 CA--C 1.542 0.654 0 CA-C-N 114.187 -1.369 . . . . 0.0 110.609 177.838 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 34.7 tt0 -64.42 -42.82 95.84 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.673 0.789 . . . . 0.0 110.33 178.492 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.421 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 99.3 mt-30 -62.31 -36.25 81.57 Favored 'General case' 0 N--CA 1.473 0.69 0 CA-C-N 115.33 -0.85 . . . . 0.0 110.06 178.768 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.532 ' O ' HG23 ' A' ' 27' ' ' VAL . 34.9 mmm-85 -64.84 -50.66 65.77 Favored 'General case' 0 C--N 1.355 0.818 0 O-C-N 123.702 0.626 . . . . 0.0 110.852 175.418 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 80.2 mt -56.63 -50.39 73.97 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.721 0 O-C-N 124.141 0.9 . . . . 0.0 109.864 -176.269 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.574 HD21 ' HB3' ' A' ' 63' ' ' LYS . 96.1 mt -61.69 -37.84 85.62 Favored 'General case' 0 N--CA 1.476 0.875 0 C-N-CA 123.594 0.758 . . . . 0.0 111.274 -179.128 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 36.9 tt0 -69.58 -44.47 70.75 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 124.016 0.926 . . . . 0.0 110.517 -176.981 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.532 HG23 ' O ' ' A' ' 23' ' ' ARG . 94.4 t -60.1 -43.12 92.15 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.215 0 C-N-CA 123.95 0.9 . . . . 0.0 110.241 176.467 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.444 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 80.6 mt -64.48 -34.96 79.42 Favored 'General case' 0 CA--C 1.55 0.972 0 CA-C-N 115.274 -0.875 . . . . 0.0 110.853 179.131 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 85.6 m -74.52 -43.15 57.25 Favored 'General case' 0 C--N 1.355 0.808 0 C-N-CA 123.644 0.778 . . . . 0.0 111.283 -179.939 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.7 mt-10 -62.67 -41.57 99.15 Favored 'General case' 0 N--CA 1.484 1.256 0 C-N-CA 123.451 0.7 . . . . 0.0 110.361 -177.963 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.52 -41.91 92.6 Favored 'General case' 0 N--CA 1.473 0.72 0 O-C-N 123.976 0.798 . . . . 0.0 110.417 173.354 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 63.62 27.61 71.24 Favored Glycine 0 C--N 1.348 1.241 0 CA-C-N 115.228 -0.896 . . . . 0.0 111.464 -170.062 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 69.9 m -159.16 161.74 27.28 Favored Pre-proline 0 CA--C 1.548 0.891 0 C-N-CA 125.016 1.326 . . . . 0.0 109.611 -166.873 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 78.4 Cg_exo -53.84 125.85 20.03 Favored 'Trans proline' 0 C--N 1.373 1.823 0 C-N-CA 122.802 2.335 . . . . 0.0 113.473 172.769 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.476 HG21 HG12 ' A' ' 27' ' ' VAL . 76.8 t -107.37 130.45 59.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.572 0 C-N-CA 124.18 0.992 . . . . 0.0 108.392 174.54 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 57.4 mttp -67.32 151.59 47.2 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.639 0.776 . . . . 0.0 110.499 -179.318 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.484 HD21 HD21 ' A' ' 52' ' ' ASN . 54.5 tp -63.04 -49.01 76.24 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.969 0.907 . . . . 0.0 110.425 179.723 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -50.09 -37.6 34.59 Favored 'General case' 0 N--CA 1.478 0.973 0 C-N-CA 123.822 0.849 . . . . 0.0 112.333 170.941 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.424 ' HG3' ' HE3' ' A' ' 42' ' ' LYS . 46.3 tt0 -73.95 -36.38 64.62 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 177.39 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 75.0 mt -62.88 -31.51 72.56 Favored 'General case' 0 N--CA 1.485 1.295 0 C-N-CA 123.272 0.629 . . . . 0.0 110.393 178.488 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.518 ' HA ' HD11 ' A' ' 51' ' ' LEU . 45.4 t -57.85 -54.03 37.18 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.936 0 O-C-N 123.573 0.546 . . . . 0.0 110.717 174.903 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.424 ' HE3' ' HG3' ' A' ' 39' ' ' GLN . 20.6 pttp -75.13 -39.21 60.69 Favored 'General case' 0 N--CA 1.473 0.689 0 CA-C-N 115.997 -0.547 . . . . 0.0 111.499 -173.796 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.1 mm-40 -65.39 -58.21 6.44 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.42 0.688 . . . . 0.0 111.87 177.547 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 37.6 m -80.97 -4.36 54.79 Favored 'General case' 0 CA--C 1.543 0.685 0 C-N-CA 122.817 0.447 . . . . 0.0 111.252 -173.717 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 62.08 31.25 17.91 Favored 'General case' 0 N--CA 1.482 1.126 0 C-N-CA 125.12 1.368 . . . . 0.0 111.597 171.219 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -128.47 150.06 73.41 Favored Pre-proline 0 N--CA 1.476 0.873 0 C-N-CA 123.52 0.728 . . . . 0.0 110.344 -175.858 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 23.3 Cg_exo -65.2 142.07 71.99 Favored 'Trans proline' 0 C--N 1.375 1.929 0 C-N-CA 122.458 2.106 . . . . 0.0 111.757 179.581 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 75.6 tttt -43.46 -41.3 4.24 Favored 'General case' 0 N--CA 1.482 1.149 0 C-N-CA 124.769 1.228 . . . . 0.0 112.051 172.893 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 61.8 mtp180 -54.09 -51.69 63.36 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 124.362 1.065 . . . . 0.0 111.625 178.006 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 38.2 tt0 -66.49 -44.9 81.36 Favored 'General case' 0 C--O 1.247 0.959 0 CA-C-N 115.504 -0.771 . . . . 0.0 110.568 -179.12 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.518 HD11 ' HA ' ' A' ' 41' ' ' VAL . 98.5 mt -54.75 -51.17 66.52 Favored 'General case' 0 C--O 1.212 -0.879 0 O-C-N 124.43 1.081 . . . . 0.0 111.253 -179.606 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.484 HD21 HD21 ' A' ' 37' ' ' LEU . 14.8 m120 -48.74 -56.75 7.73 Favored 'General case' 0 N--CA 1.48 1.049 0 C-N-CA 124.087 0.955 . . . . 0.0 112.194 -179.127 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 -58.93 -41.89 88.46 Favored 'General case' 0 CA--C 1.546 0.825 0 O-C-N 123.997 0.81 . . . . 0.0 112.115 -176.522 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.506 HG13 HH21 ' A' ' 57' ' ' ARG . 86.1 t -68.95 -48.31 70.92 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.915 0 C-N-CA 122.987 0.515 . . . . 0.0 110.259 178.36 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 29.6 mt -55.59 -38.29 69.2 Favored 'General case' 0 N--CA 1.485 1.281 0 C-N-CA 125.563 1.545 . . . . 0.0 114.178 -178.766 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 23.0 m-85 -70.41 -30.78 67.75 Favored 'General case' 0 N--CA 1.48 1.067 0 CA-C-N 118.767 0.712 . . . . 0.0 110.792 178.092 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.506 HH21 HG13 ' A' ' 54' ' ' VAL . 46.5 ttp180 -71.42 -44.23 65.26 Favored 'General case' 0 CA--C 1.541 0.608 0 O-C-N 123.858 0.724 . . . . 0.0 109.348 176.389 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.461 ' SD ' HG12 ' A' ' 54' ' ' VAL . 80.5 mtp -63.55 -31.98 73.3 Favored 'General case' 0 N--CA 1.479 0.994 0 C-N-CA 124.335 1.054 . . . . 0.0 111.046 176.0 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 38.3 ttmt -62.52 -44.92 95.17 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.708 0.803 . . . . 0.0 110.611 174.809 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.425 ' HD2' ' HA ' ' A' ' 57' ' ' ARG . 52.7 mttm -63.02 -35.9 81.77 Favored 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 123.623 0.769 . . . . 0.0 110.749 176.499 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.4 mm-40 -85.88 5.25 33.74 Favored 'General case' 0 N--CA 1.476 0.844 0 C-N-CA 123.555 0.742 . . . . 0.0 111.312 178.821 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 92.8 mt 66.36 9.95 6.84 Favored 'General case' 0 N--CA 1.494 1.757 0 C-N-CA 125.218 1.407 . . . . 0.0 113.016 174.367 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.574 ' HB3' HD21 ' A' ' 25' ' ' LEU . 94.2 mttt -69.11 -35.34 76.32 Favored 'General case' 0 N--CA 1.472 0.635 0 C-N-CA 124.372 1.069 . . . . 0.0 111.094 -178.835 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.5 m -129.8 158.67 42.3 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 C-N-CA 123.613 0.765 . . . . 0.0 109.919 177.586 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 36.1 m -132.92 152.85 51.83 Favored 'General case' 0 C--O 1.239 0.514 0 C-N-CA 124.421 1.089 . . . . 0.0 108.075 172.78 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 22.7 tp -97.96 112.77 24.58 Favored 'General case' 0 CA--C 1.535 0.404 0 N-CA-C 107.898 -1.149 . . . . 0.0 107.898 179.133 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 17.1 p -87.58 -37.72 16.59 Favored 'General case' 0 N--CA 1.476 0.866 0 C-N-CA 123.12 0.568 . . . . 0.0 111.553 -178.972 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.624 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 9.2 t -140.59 155.09 69.75 Favored Pre-proline 0 CA--C 1.553 1.087 0 N-CA-C 107.072 -1.455 . . . . 0.0 107.072 -176.663 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 0.9 OUTLIER -26.18 -68.57 0.04 OUTLIER 'Trans proline' 0 C--N 1.391 2.799 0 C-N-CA 125.071 3.847 . . . . 0.0 116.495 -176.923 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -115.22 41.35 2.46 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.186 0.594 . . . . 0.0 110.902 176.138 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.624 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 26.5 m -129.37 125.71 37.23 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.641 0.776 . . . . 0.0 108.955 174.752 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.4 m95 -108.27 163.83 12.85 Favored 'General case' 0 N--CA 1.466 0.343 0 C-N-CA 123.802 0.841 . . . . 0.0 109.219 -175.691 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.428 ' HA ' HD22 ' A' ' 28' ' ' LEU . 43.9 t -146.3 164.02 33.68 Favored 'General case' 0 C--N 1.323 -0.562 0 N-CA-C 108.99 -0.744 . . . . 0.0 108.99 177.195 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.444 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 35.2 tp -68.35 135.38 51.75 Favored 'General case' 0 C--O 1.24 0.589 0 N-CA-C 108.415 -0.958 . . . . 0.0 108.415 174.425 . . . . . . . . 2 2 . 1 . 001 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.89 75.59 0.31 Allowed Glycine 0 C--N 1.351 1.393 0 O-C-N 124.174 0.922 . . . . 0.0 111.608 179.348 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 74.28 -82.45 0.78 Allowed Glycine 0 C--N 1.346 1.096 0 N-CA-C 111.172 -0.771 . . . . 0.0 111.172 -171.164 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 14.9 t -162.11 -160.48 0.68 Allowed 'General case' 0 CA--C 1.548 0.898 0 C-N-CA 124.851 1.26 . . . . 0.0 108.01 176.751 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 15.0 m-20 -61.6 126.02 85.85 Favored Pre-proline 0 N--CA 1.474 0.747 0 N-CA-C 109.045 -0.724 . . . . 0.0 109.045 167.295 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 37.3 Cg_endo -64.65 98.66 0.3 Allowed 'Trans proline' 0 C--N 1.374 1.878 0 C-N-CA 122.355 2.037 . . . . 0.0 111.196 178.679 . . . . . . . . 1 1 . 1 . 001 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 . . . . . 0 CA--C 1.553 1.071 0 C-N-CA 123.474 0.71 . . . . 0.0 109.458 -179.351 . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.8 tpt . . . . . 0 N--CA 1.479 0.985 0 N-CA-C 109.841 -0.429 . . . . 0.0 109.841 . . . . . . . . . 0 0 . 1 . 002 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 59.22 45.71 94.94 Favored Glycine 0 C--N 1.351 1.401 0 CA-C-N 115.681 -0.691 . . . . 0.0 113.477 179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 53.5 t-80 69.29 162.29 0.22 Allowed 'General case' 0 N--CA 1.495 1.792 0 C-N-CA 124.869 1.268 . . . . 0.0 111.331 -176.255 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 45.2 m80 -52.45 121.67 7.44 Favored 'General case' 0 N--CA 1.483 1.178 0 C-N-CA 123.234 0.614 . . . . 0.0 109.362 170.039 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 -46.17 -51.46 14.08 Favored 'General case' 0 N--CA 1.487 1.416 0 C-N-CA 124.72 1.208 . . . . 0.0 112.135 -170.744 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.5 t60 -162.04 104.62 1.16 Allowed 'General case' 0 C--O 1.236 0.387 0 N-CA-C 107.09 -1.448 . . . . 0.0 107.09 173.411 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 t60 -61.03 92.32 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.726 0.81 . . . . 0.0 109.983 178.618 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 51.6 t-80 56.13 -80.38 0.01 OUTLIER 'General case' 0 N--CA 1.484 1.252 0 C-N-CA 125.268 1.427 . . . . 0.0 112.137 179.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 58.9 p -153.18 2.0 0.28 Allowed 'General case' 0 CA--C 1.544 0.74 0 C-N-CA 123.324 0.649 . . . . 0.0 111.593 -178.81 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 50.3 t-80 67.45 6.3 4.83 Favored 'General case' 0 N--CA 1.49 1.529 0 C-N-CA 125.136 1.375 . . . . 0.0 110.607 -169.219 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 56.9 mtt -145.49 -171.93 3.78 Favored 'General case' 0 C--O 1.245 0.84 0 C-N-CA 125.805 1.642 . . . . 0.0 107.743 -172.13 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -77.83 -174.38 3.49 Favored 'General case' 0 CA--C 1.553 1.071 0 N-CA-C 109.192 -0.67 . . . . 0.0 109.192 165.272 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . 0.596 ' HB2' ' HG2' ' A' ' 16' ' ' ARG . 6.3 m-20 -70.92 134.44 85.71 Favored Pre-proline 0 N--CA 1.484 1.251 0 O-C-N 122.093 -0.379 . . . . 0.0 110.504 177.954 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 31.7 Cg_endo -62.39 121.19 9.07 Favored 'Trans proline' 0 C--N 1.375 1.956 0 C-N-CA 122.793 2.329 . . . . 0.0 110.988 178.118 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 45.82 58.97 5.19 Favored Glycine 0 C--N 1.355 1.601 0 O-C-N 124.338 1.024 . . . . 0.0 114.073 -178.668 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.596 ' HG2' ' HB2' ' A' ' 13' ' ' ASP . 36.0 mtp-105 -47.73 -60.92 2.22 Favored 'General case' 0 N--CA 1.487 1.397 0 C-N-CA 124.621 1.169 . . . . 0.0 112.848 -172.344 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 7.5 mp0 -65.53 -35.58 81.28 Favored 'General case' 0 N--CA 1.475 0.803 0 O-C-N 123.942 0.776 . . . . 0.0 111.524 -173.639 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.42 -52.76 47.97 Favored Glycine 0 C--N 1.346 1.134 0 N-CA-C 114.371 0.508 . . . . 0.0 114.371 171.68 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 58.4 m80 -67.27 -36.04 80.76 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 122.961 0.504 . . . . 0.0 110.155 -179.165 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.421 ' O ' HG13 ' A' ' 24' ' ' ILE . 0.2 OUTLIER -64.37 -51.88 61.08 Favored 'General case' 0 CA--C 1.548 0.891 0 CA-C-N 114.89 -1.05 . . . . 0.0 110.123 179.579 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.29 -47.43 79.54 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.96 0.904 . . . . 0.0 111.108 -175.444 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.0 OUTLIER -61.33 -38.11 85.7 Favored 'General case' 0 C--N 1.355 0.833 0 O-C-N 124.067 0.854 . . . . 0.0 110.739 -177.855 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.434 ' O ' HG23 ' A' ' 27' ' ' VAL . 14.1 tpp180 -71.83 -38.51 70.15 Favored 'General case' 0 CA--C 1.545 0.768 0 C-N-CA 122.986 0.514 . . . . 0.0 110.857 -178.094 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.421 HG13 ' O ' ' A' ' 20' ' ' LEU . 82.5 mt -58.76 -51.76 68.23 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.312 0 C-N-CA 122.806 0.443 . . . . 0.0 109.934 174.592 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.409 HD21 ' HB3' ' A' ' 63' ' ' LYS . 98.6 mt -56.1 -43.15 77.82 Favored 'General case' 0 C--N 1.363 1.181 0 C-N-CA 123.672 0.789 . . . . 0.0 110.905 178.192 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 41.1 tt0 -61.64 -51.18 69.51 Favored 'General case' 0 N--CA 1.474 0.762 0 O-C-N 124.194 0.934 . . . . 0.0 111.12 -175.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.434 HG23 ' O ' ' A' ' 23' ' ' ARG . 87.7 t -57.82 -41.97 80.98 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 O-C-N 124.133 0.896 . . . . 0.0 110.971 179.991 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 94.3 mt -70.05 -33.11 71.53 Favored 'General case' 0 CA--C 1.545 0.779 0 CA-C-N 115.269 -0.878 . . . . 0.0 111.252 -179.559 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 37.6 m -71.64 -49.43 40.08 Favored 'General case' 0 C--N 1.359 0.998 0 C-N-CA 123.432 0.693 . . . . 0.0 112.12 177.928 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.7 mt-10 -62.51 -36.46 82.64 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.21 0.604 . . . . 0.0 110.268 -176.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.62 -38.35 70.81 Favored 'General case' 0 C--N 1.346 0.446 0 CA-C-N 115.51 -0.768 . . . . 0.0 110.815 171.975 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.52 22.98 64.33 Favored Glycine 0 C--N 1.351 1.409 0 O-C-N 124.031 0.832 . . . . 0.0 113.342 -176.859 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 52.6 m -152.62 164.88 18.89 Favored Pre-proline 0 CA--C 1.553 1.088 0 C-N-CA 124.149 0.98 . . . . 0.0 109.724 -167.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.7 Cg_exo -58.93 117.09 3.76 Favored 'Trans proline' 0 C--N 1.383 2.366 0 C-N-CA 122.364 2.043 . . . . 0.0 112.509 172.397 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 74.4 t -111.31 133.2 57.66 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.849 0 C-N-CA 124.625 1.17 . . . . 0.0 108.573 177.466 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.429 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 59.4 mtpt -68.77 144.58 54.29 Favored 'General case' 0 CA--C 1.54 0.563 0 C-N-CA 123.347 0.659 . . . . 0.0 109.875 177.886 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.478 HD13 HD11 ' A' ' 55' ' ' LEU . 29.1 tp -58.48 -40.44 82.74 Favored 'General case' 0 N--CA 1.48 1.055 0 O-C-N 123.721 0.638 . . . . 0.0 110.808 176.204 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.02 -44.83 2.48 Favored 'General case' 0 N--CA 1.48 1.034 0 C-N-CA 124.418 1.087 . . . . 0.0 113.16 167.133 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.8 tt0 -81.66 -32.61 31.73 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 122.346 0.258 . . . . 0.0 110.536 178.44 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.3 mt -58.62 -33.52 70.13 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 122.666 0.387 . . . . 0.0 110.194 -179.898 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 37' ' ' LEU . 99.0 t -52.8 -58.8 2.18 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.107 0 C-N-CA 123.78 0.832 . . . . 0.0 112.285 173.49 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 6.5 ptpp? -70.5 -40.96 73.27 Favored 'General case' 0 N--CA 1.478 0.955 0 N-CA-C 112.149 0.425 . . . . 0.0 112.149 -173.808 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 15.4 mm-40 -69.33 -43.58 73.4 Favored 'General case' 0 N--CA 1.476 0.854 0 N-CA-C 112.162 0.43 . . . . 0.0 112.162 -179.076 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 82.0 m -77.77 -15.47 59.08 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 112.133 0.42 . . . . 0.0 112.133 -179.112 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 29.0 mm-40 61.28 26.15 16.03 Favored 'General case' 0 N--CA 1.49 1.566 0 C-N-CA 123.786 0.835 . . . . 0.0 110.296 -173.698 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.91 143.75 31.4 Favored Pre-proline 0 CA--C 1.541 0.619 0 C-N-CA 124.124 0.969 . . . . 0.0 110.081 -171.652 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 21.3 Cg_exo -68.66 138.32 41.23 Favored 'Trans proline' 0 C--N 1.369 1.641 0 C-N-CA 122.583 2.189 . . . . 0.0 111.615 174.098 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 64.2 tttp -47.99 -30.3 4.19 Favored 'General case' 0 CA--C 1.55 0.98 0 C-N-CA 125.218 1.407 . . . . 0.0 112.721 176.15 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 mtm180 -56.45 -56.69 18.01 Favored 'General case' 0 N--CA 1.486 1.343 0 C-N-CA 124.143 0.977 . . . . 0.0 111.136 174.871 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.417 ' HA ' HE21 ' A' ' 53' ' ' GLN . 3.5 mp0 -66.23 -43.01 87.82 Favored 'General case' 0 N--CA 1.475 0.809 0 C-N-CA 124.318 1.047 . . . . 0.0 111.21 -177.493 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 60.7 mt -54.74 -52.9 61.07 Favored 'General case' 0 C--O 1.209 -1.048 0 O-C-N 124.448 1.093 . . . . 0.0 110.098 175.789 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.8 m120 -47.53 -58.9 3.67 Favored 'General case' 0 N--CA 1.493 1.714 0 C-N-CA 124.283 1.033 . . . . 0.0 112.08 176.363 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.417 HE21 ' HA ' ' A' ' 50' ' ' GLU . 46.8 mt-30 -53.51 -50.88 64.48 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 124.226 1.01 . . . . 0.0 112.339 -177.563 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.2 t -68.29 -43.68 84.34 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.048 0 C-N-CA 123.147 0.579 . . . . 0.0 111.462 -178.097 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.478 HD11 HD13 ' A' ' 37' ' ' LEU . 27.8 mt -48.19 -48.5 34.66 Favored 'General case' 0 N--CA 1.484 1.258 0 C-N-CA 124.992 1.317 . . . . 0.0 114.265 -179.71 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 86.4 m-85 -72.48 -25.62 61.49 Favored 'General case' 0 N--CA 1.484 1.261 0 CA-C-N 119.392 0.996 . . . . 0.0 111.86 -176.563 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 69.5 ttt180 -70.31 -55.34 9.42 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 109.784 -0.45 . . . . 0.0 109.784 175.468 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.459 ' HB2' ' HB2' ' A' ' 63' ' ' LYS . 18.0 ptm -67.99 -23.85 65.07 Favored 'General case' 0 CA--C 1.55 0.95 0 CA-C-N 115.542 -0.754 . . . . 0.0 110.922 -178.29 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 52.2 tttm -69.15 -43.1 74.99 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.608 0.763 . . . . 0.0 110.72 171.663 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.407 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 0.0 OUTLIER -59.19 -37.88 78.48 Favored 'General case' 0 CA--C 1.545 0.761 0 C-N-CA 123.98 0.912 . . . . 0.0 110.577 175.298 . . . . . . . . 3 3 . 1 . 002 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 39.3 mt-10 -86.21 -0.49 55.87 Favored 'General case' 0 CA--C 1.549 0.921 0 CA-C-N 115.056 -0.975 . . . . 0.0 112.038 179.086 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.3 mt 60.8 24.72 14.62 Favored 'General case' 0 N--CA 1.49 1.542 0 C-N-CA 125.068 1.347 . . . . 0.0 112.688 176.321 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.459 ' HB2' ' HB2' ' A' ' 58' ' ' MET . 55.1 mttm -67.5 -32.13 72.74 Favored 'General case' 0 N--CA 1.475 0.811 0 C-N-CA 124.505 1.122 . . . . 0.0 109.569 168.25 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.458 HG22 ' HG3' ' A' ' 58' ' ' MET . 28.1 m -133.37 160.79 42.17 Favored 'Isoleucine or valine' 0 C--O 1.241 0.656 0 CA-C-N 114.471 -1.24 . . . . 0.0 108.558 171.719 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 42.1 m -129.85 156.46 44.34 Favored 'General case' 0 C--N 1.328 -0.359 0 N-CA-C 108.72 -0.844 . . . . 0.0 108.72 171.541 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.4 tp -103.07 112.4 25.22 Favored 'General case' 0 N--CA 1.466 0.371 0 N-CA-C 107.572 -1.27 . . . . 0.0 107.572 -179.041 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.9 p -94.9 -43.82 8.01 Favored 'General case' 0 N--CA 1.472 0.642 0 C-N-CA 122.696 0.399 . . . . 0.0 111.23 -174.597 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.694 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 19.6 m -132.93 162.34 58.19 Favored Pre-proline 0 N--CA 1.481 1.084 0 C-N-CA 123.478 0.711 . . . . 0.0 110.183 -175.274 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 50.6 Cg_exo -55.6 115.86 2.75 Favored 'Trans proline' 0 C--N 1.379 2.175 0 C-N-CA 122.972 2.448 . . . . 0.0 112.247 175.691 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 70.54 9.89 7.02 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 125.42 1.488 . . . . 0.0 112.386 179.896 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.694 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 28.0 m -124.58 121.77 35.7 Favored 'General case' 0 N--CA 1.476 0.83 0 C-N-CA 123.258 0.623 . . . . 0.0 109.418 -174.501 . . . . . . . . 2 2 . 1 . 002 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.6 m95 -107.67 165.83 11.14 Favored 'General case' 0 N--CA 1.466 0.345 0 C-N-CA 124.272 1.029 . . . . 0.0 109.591 -172.306 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 52.2 t -146.15 158.58 43.88 Favored 'General case' 0 N--CA 1.47 0.535 0 N-CA-C 108.569 -0.901 . . . . 0.0 108.569 178.735 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 43.5 tp -69.46 138.35 53.38 Favored 'General case' 0 CA--C 1.543 0.695 0 O-C-N 123.477 0.486 . . . . 0.0 110.186 177.654 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -79.32 71.13 2.7 Favored Glycine 0 C--N 1.343 0.969 0 N-CA-C 111.312 -0.715 . . . . 0.0 111.312 176.116 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 70.85 -79.43 0.48 Allowed Glycine 0 C--N 1.35 1.347 0 N-CA-C 111.779 -0.528 . . . . 0.0 111.779 -173.852 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.4 t -154.76 13.07 0.4 Allowed 'General case' 0 CA--C 1.553 1.093 0 C-N-CA 124.515 1.126 . . . . 0.0 110.525 177.638 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.4 t70 62.49 85.12 0.18 Allowed Pre-proline 0 N--CA 1.483 1.223 0 C-N-CA 124.184 0.994 . . . . 0.0 109.218 -165.296 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.8 Cg_endo -74.73 -25.18 12.7 Favored 'Trans proline' 0 C--N 1.376 1.979 0 C-N-CA 122.491 2.127 . . . . 0.0 113.259 -179.89 . . . . . . . . 1 1 . 1 . 002 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 30.8 tt0 . . . . . 0 C--O 1.249 1.072 0 CA-C-O 119.112 -0.471 . . . . 0.0 109.981 -173.175 . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.5 mpt? . . . . . 0 N--CA 1.474 0.737 0 N-CA-C 109.607 -0.516 . . . . 0.0 109.607 . . . . . . . . . 0 0 . 1 . 003 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -59.32 112.37 4.19 Favored Glycine 0 C--N 1.355 1.627 0 O-C-N 124.322 1.014 . . . . 0.0 112.832 -178.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 10.6 p-80 -145.76 8.71 1.14 Allowed 'General case' 0 N--CA 1.476 0.861 0 C-N-CA 122.912 0.485 . . . . 0.0 112.226 -177.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -66.49 106.18 1.69 Allowed 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 109.296 -0.631 . . . . 0.0 109.296 178.053 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.539 ' HA ' ' OG ' ' A' ' 9' ' ' SER . 95.8 m-70 -72.86 72.08 1.07 Allowed 'General case' 0 N--CA 1.484 1.253 0 C-N-CA 124.014 0.925 . . . . 0.0 112.027 -172.562 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 89.6 m-70 -153.4 50.97 0.71 Allowed 'General case' 0 N--CA 1.481 1.114 0 C-N-CA 125.727 1.611 . . . . 0.0 107.273 -178.463 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 82.3 t60 68.39 6.58 5.44 Favored 'General case' 0 N--CA 1.495 1.809 0 C-N-CA 124.715 1.206 . . . . 0.0 111.345 -174.318 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 78.3 m80 -125.47 31.71 5.49 Favored 'General case' 0 N--CA 1.475 0.801 0 C-N-CA 123.859 0.864 . . . . 0.0 109.915 -177.993 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.539 ' OG ' ' HA ' ' A' ' 5' ' ' HIS . 17.7 m -79.2 22.26 0.42 Allowed 'General case' 0 N--CA 1.492 1.67 0 C-N-CA 123.446 0.698 . . . . 0.0 111.885 177.107 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 7.6 p80 -150.41 157.44 43.04 Favored 'General case' 0 C--O 1.241 0.632 0 C-N-CA 125.186 1.394 . . . . 0.0 107.752 -176.699 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 14.1 tpt -91.07 90.33 7.79 Favored 'General case' 0 C--O 1.238 0.489 0 N-CA-C 109.023 -0.732 . . . . 0.0 109.023 175.474 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -65.53 94.57 0.19 Allowed 'General case' 0 N--CA 1.473 0.704 0 N-CA-C 108.803 -0.814 . . . . 0.0 108.803 175.64 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.3 m-20 65.87 116.07 0.03 OUTLIER Pre-proline 0 CA--C 1.556 1.174 0 O-C-N 124.887 1.367 . . . . 0.0 109.971 -170.2 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 12.4 Cg_exo -72.5 32.91 0.29 Allowed 'Trans proline' 0 N--CA 1.5 1.906 0 C-N-CA 123.459 2.772 . . . . 0.0 114.481 177.316 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -50.29 -59.76 7.37 Favored Glycine 0 C--N 1.355 1.586 0 N-CA-C 115.134 0.814 . . . . 0.0 115.134 178.133 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 5.3 mpt_? -64.46 -43.42 94.28 Favored 'General case' 0 C--N 1.358 0.951 0 CA-C-N 117.573 0.686 . . . . 0.0 112.408 -176.425 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 60.9 mt-10 -66.25 -41.21 90.3 Favored 'General case' 0 N--CA 1.478 0.966 0 C-N-CA 122.838 0.455 . . . . 0.0 111.93 178.011 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -69.05 -29.13 72.39 Favored Glycine 0 C--N 1.343 0.929 0 O-C-N 123.996 0.81 . . . . 0.0 112.592 178.645 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 64.4 t-80 -84.01 -31.89 25.21 Favored 'General case' 0 N--CA 1.481 1.086 0 N-CA-C 109.942 -0.392 . . . . 0.0 109.942 178.081 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD11 HD23 ' A' ' 51' ' ' LEU . 2.4 tm? -65.16 -42.29 93.87 Favored 'General case' 0 N--CA 1.475 0.806 0 C-N-CA 124.322 1.049 . . . . 0.0 109.059 172.005 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 31.7 tt0 -62.88 -43.57 98.44 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 125.1 1.36 . . . . 0.0 109.444 173.601 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 21.1 tm0? -60.81 -44.12 97.29 Favored 'General case' 0 N--CA 1.471 0.589 0 CA-C-N 114.992 -1.004 . . . . 0.0 110.006 179.46 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.417 ' O ' HG23 ' A' ' 27' ' ' VAL . 27.7 tpt180 -68.47 -43.29 77.28 Favored 'General case' 0 C--N 1.347 0.483 0 O-C-N 123.685 0.616 . . . . 0.0 111.141 -177.109 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.427 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 84.7 mt -57.07 -50.33 76.71 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.847 0 N-CA-C 108.879 -0.786 . . . . 0.0 108.879 176.621 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 93.6 mt -65.88 -32.5 74.04 Favored 'General case' 0 C--N 1.35 0.603 0 C-N-CA 123.503 0.721 . . . . 0.0 111.29 -177.728 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.453 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 20.2 tp60 -68.93 -45.27 71.22 Favored 'General case' 0 C--O 1.219 -0.508 0 C-N-CA 123.003 0.521 . . . . 0.0 110.1 -179.708 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 23' ' ' ARG . 80.5 t -62.06 -36.79 76.12 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.76 0 C-N-CA 123.386 0.674 . . . . 0.0 110.303 177.471 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.427 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 96.2 mt -66.14 -39.91 90.2 Favored 'General case' 0 CA--C 1.545 0.77 0 CA-C-N 115.578 -0.737 . . . . 0.0 110.552 177.172 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 62.6 m -72.03 -48.6 43.36 Favored 'General case' 0 CA--C 1.544 0.734 0 C-N-CA 124.328 1.051 . . . . 0.0 111.984 -178.036 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.453 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 6.8 mm-40 -68.65 -34.85 76.43 Favored 'General case' 0 N--CA 1.481 1.113 0 CA-C-N 118.085 0.402 . . . . 0.0 111.141 -175.251 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.07 -39.36 90.02 Favored 'General case' 0 N--CA 1.465 0.321 0 CA-C-N 115.526 -0.761 . . . . 0.0 110.351 170.628 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.12 23.03 59.09 Favored Glycine 0 C--N 1.356 1.659 0 O-C-N 123.86 0.725 . . . . 0.0 112.321 -174.401 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.5 m -153.43 150.15 22.91 Favored Pre-proline 0 C--O 1.24 0.569 0 C-N-CA 124.574 1.15 . . . . 0.0 108.346 -169.398 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.594 ' HB3' ' SG ' ' A' ' 73' ' ' CYS . 6.1 Cg_endo -48.53 112.77 0.67 Allowed 'Trans proline' 0 C--N 1.375 1.969 0 C-N-CA 123.804 3.002 . . . . 0.0 113.026 175.918 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 85.4 t -96.82 136.72 26.66 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.785 0 N-CA-C 108.312 -0.996 . . . . 0.0 108.312 -179.844 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 54.0 mtpt -77.53 155.93 31.29 Favored 'General case' 0 N--CA 1.475 0.785 0 N-CA-C 109.461 -0.57 . . . . 0.0 109.461 179.878 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.462 ' O ' HG23 ' A' ' 41' ' ' VAL . 23.0 tp -64.27 -46.23 84.58 Favored 'General case' 0 N--CA 1.471 0.593 0 C-N-CA 124.045 0.938 . . . . 0.0 109.122 -179.9 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.31 -44.37 33.87 Favored 'General case' 0 CA--C 1.544 0.729 0 C-N-CA 124.02 0.928 . . . . 0.0 112.48 168.389 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 50.4 tt0 -72.69 -32.34 65.71 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 117.953 0.342 . . . . 0.0 110.363 179.001 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 83.6 mt -62.15 -35.63 79.36 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 122.849 0.459 . . . . 0.0 110.198 176.76 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.462 HG23 ' O ' ' A' ' 37' ' ' LEU . 61.2 t -56.06 -54.7 24.18 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.016 0 C-N-CA 123.353 0.661 . . . . 0.0 111.563 177.261 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.1 ptmt -71.98 -45.81 59.61 Favored 'General case' 0 N--CA 1.474 0.75 0 CA-C-N 115.977 -0.556 . . . . 0.0 111.527 -175.178 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 14.2 mm-40 -64.44 -39.62 94.18 Favored 'General case' 0 N--CA 1.476 0.851 0 N-CA-C 112.447 0.536 . . . . 0.0 112.447 -178.764 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 68.5 m -82.24 -18.54 42.17 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-O 119.242 -0.408 . . . . 0.0 111.426 179.231 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 22.7 mm-40 59.11 31.55 21.39 Favored 'General case' 0 N--CA 1.485 1.313 0 C-N-CA 123.831 0.852 . . . . 0.0 109.905 -173.048 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.28 146.79 45.5 Favored Pre-proline 0 C--O 1.241 0.642 0 CA-C-N 114.779 -1.101 . . . . 0.0 110.239 -169.038 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.7 Cg_exo -63.76 129.41 24.74 Favored 'Trans proline' 0 C--N 1.375 1.962 0 C-N-CA 122.802 2.335 . . . . 0.0 112.391 179.4 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 5.1 ttpm? -51.78 -28.67 16.16 Favored 'General case' 0 N--CA 1.481 1.089 0 O-C-N 124.341 1.026 . . . . 0.0 112.925 177.588 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 16.3 mtm180 -53.96 -57.03 12.51 Favored 'General case' 0 N--CA 1.481 1.097 0 C-N-CA 123.525 0.73 . . . . 0.0 110.392 173.054 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.423 ' O ' HG23 ' A' ' 54' ' ' VAL . 1.1 mp0 -66.75 -44.45 81.47 Favored 'General case' 0 C--N 1.346 0.453 0 CA-C-N 114.579 -1.191 . . . . 0.0 110.768 -175.705 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.482 HD23 HD11 ' A' ' 20' ' ' LEU . 92.2 mt -55.71 -56.38 21.08 Favored 'General case' 0 N--CA 1.469 0.487 0 O-C-N 124.208 0.942 . . . . 0.0 110.401 178.357 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 27.7 t-20 -48.7 -53.11 20.11 Favored 'General case' 0 N--CA 1.482 1.143 0 C-N-CA 124.798 1.239 . . . . 0.0 111.374 178.486 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 33.5 tt0 -52.15 -56.89 11.67 Favored 'General case' 0 C--O 1.247 0.954 0 C-N-CA 124.1 0.96 . . . . 0.0 112.619 177.11 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.664 HG12 ' SD ' ' A' ' 58' ' ' MET . 60.7 t -66.68 -35.56 75.09 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.792 0 CA-C-N 115.48 -0.782 . . . . 0.0 111.001 -173.88 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 36.3 mt -52.15 -48.79 64.72 Favored 'General case' 0 N--CA 1.484 1.226 0 C-N-CA 124.479 1.111 . . . . 0.0 113.262 -179.881 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 39.7 m-85 -73.88 -25.18 59.9 Favored 'General case' 0 N--CA 1.477 0.922 0 CA-C-N 118.253 0.479 . . . . 0.0 110.782 -175.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 79.0 ttt180 -67.59 -52.28 40.39 Favored 'General case' 0 CA--C 1.539 0.556 0 C-N-CA 123.587 0.755 . . . . 0.0 109.418 172.309 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.664 ' SD ' HG12 ' A' ' 54' ' ' VAL . 70.7 mtp -59.74 -26.58 65.78 Favored 'General case' 0 N--CA 1.475 0.815 0 C-N-CA 124.489 1.116 . . . . 0.0 111.368 176.007 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 79.1 tttt -70.99 -37.2 72.71 Favored 'General case' 0 N--CA 1.472 0.662 0 C-N-CA 122.777 0.431 . . . . 0.0 110.167 178.568 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 75.8 mmtt -69.31 -30.67 68.78 Favored 'General case' 0 N--CA 1.474 0.763 0 C-N-CA 123.088 0.555 . . . . 0.0 110.412 173.247 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 11.4 mm-40 -77.62 -5.66 51.09 Favored 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.267 0.627 . . . . 0.0 111.271 174.497 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 55.4 mt 68.13 17.58 9.41 Favored 'General case' 0 N--CA 1.482 1.125 0 C-N-CA 124.884 1.274 . . . . 0.0 111.037 177.902 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 99.3 mttt -81.75 -28.67 33.21 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 124.889 1.276 . . . . 0.0 111.803 179.203 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 32.9 m -130.86 158.8 43.22 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 C-N-CA 123.225 0.61 . . . . 0.0 109.665 174.825 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.5 m -143.65 149.45 37.28 Favored 'General case' 0 N--CA 1.472 0.632 0 N-CA-C 108.819 -0.808 . . . . 0.0 108.819 178.589 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 18.7 tp -101.28 108.54 20.21 Favored 'General case' 0 C--O 1.24 0.575 0 N-CA-C 108.149 -1.056 . . . . 0.0 108.149 -177.332 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.428 HG21 ' SG ' ' A' ' 73' ' ' CYS . 33.7 p -99.04 -32.21 11.39 Favored 'General case' 0 N--CA 1.476 0.835 0 CA-C-O 121.25 0.548 . . . . 0.0 111.093 -176.375 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.564 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 35.8 t -140.22 153.83 69.36 Favored Pre-proline 0 CA--C 1.549 0.907 0 N-CA-C 108.059 -1.089 . . . . 0.0 108.059 -177.994 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 53.1 Cg_exo -43.67 114.18 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.519 0 C-N-CA 123.549 2.833 . . . . 0.0 114.011 175.155 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 59.8 26.89 16.11 Favored 'General case' 0 N--CA 1.482 1.169 0 C-N-CA 124.753 1.221 . . . . 0.0 112.117 179.564 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.564 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 41.9 m -130.88 125.33 33.28 Favored 'General case' 0 C--O 1.242 0.669 0 C-N-CA 123.259 0.624 . . . . 0.0 109.516 179.854 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 67.0 m95 -117.44 146.53 43.41 Favored 'General case' 0 C--N 1.333 -0.146 0 C-N-CA 124.023 0.929 . . . . 0.0 109.205 -170.795 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.594 ' SG ' ' HB3' ' A' ' 34' ' ' PRO . 78.4 m -113.68 158.66 20.59 Favored 'General case' 0 C--O 1.25 1.115 0 N-CA-C 108.859 -0.793 . . . . 0.0 108.859 172.431 . . . . . . . . 2 2 . 1 . 003 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 33.1 tp -64.97 102.31 0.6 Allowed 'General case' 0 CA--C 1.539 0.534 0 CA-C-N 115.407 -0.815 . . . . 0.0 108.988 174.04 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -82.94 -31.75 28.29 Favored Glycine 0 C--N 1.335 0.497 0 CA-C-N 115.968 -0.56 . . . . 0.0 111.945 178.331 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -98.99 170.2 23.58 Favored Glycine 0 C--N 1.346 1.123 0 C-N-CA 122.969 0.319 . . . . 0.0 112.481 -174.552 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 26.6 m -91.66 72.03 5.84 Favored 'General case' 0 CA--C 1.552 1.023 0 CA-C-O 121.942 0.877 . . . . 0.0 109.837 -179.284 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 28.6 t70 -71.33 -51.69 9.71 Favored Pre-proline 0 CA--C 1.559 1.324 0 CA-C-N 114.588 -1.187 . . . . 0.0 113.013 177.774 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 52.2 Cg_endo -65.43 -21.7 60.27 Favored 'Trans proline' 0 C--N 1.38 2.216 0 C-N-CA 122.24 1.96 . . . . 0.0 113.72 -172.945 . . . . . . . . 1 1 . 1 . 003 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.0 mm-40 . . . . . 0 N--CA 1.473 0.709 0 N-CA-C 108.7 -0.852 . . . . 0.0 108.7 -175.999 . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.8 ttt . . . . . 0 N--CA 1.483 1.221 0 N-CA-C 109.285 -0.635 . . . . 0.0 109.285 . . . . . . . . . 0 0 . 1 . 004 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -68.24 90.25 0.22 Allowed Glycine 0 C--N 1.351 1.366 0 CA-C-O 119.987 -0.34 . . . . 0.0 112.971 178.888 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 45.2 t-80 70.04 147.26 0.07 Allowed 'General case' 0 N--CA 1.489 1.508 0 C-N-CA 125.867 1.667 . . . . 0.0 112.193 -178.64 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.6 p-80 -141.01 151.06 43.82 Favored 'General case' 0 C--O 1.243 0.753 0 C-N-CA 124.55 1.14 . . . . 0.0 108.882 174.011 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 79.6 t60 -158.62 102.98 1.72 Allowed 'General case' 0 N--CA 1.474 0.757 0 C-N-CA 123.124 0.569 . . . . 0.0 110.66 176.527 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 39.3 m80 -135.69 -10.9 2.09 Favored 'General case' 0 N--CA 1.482 1.167 0 C-N-CA 123.71 0.804 . . . . 0.0 110.727 171.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 40.8 m80 -143.66 -152.53 0.42 Allowed 'General case' 0 N--CA 1.483 1.2 0 C-N-CA 123.723 0.809 . . . . 0.0 109.359 -179.179 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 51.4 t-80 68.32 -87.31 0.03 OUTLIER 'General case' 0 C--N 1.364 1.207 0 C-N-CA 124.993 1.317 . . . . 0.0 111.13 179.401 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 66.8 m -78.08 -16.12 58.3 Favored 'General case' 0 N--CA 1.477 0.893 0 C-N-CA 122.961 0.505 . . . . 0.0 111.465 -176.164 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 54.4 t-80 -143.72 87.25 1.91 Allowed 'General case' 0 CA--C 1.538 0.486 0 N-CA-C 108.578 -0.897 . . . . 0.0 108.578 -179.763 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 22.0 ptt? -147.28 105.53 3.77 Favored 'General case' 0 CA--C 1.54 0.558 0 C-N-CA 124.417 1.087 . . . . 0.0 108.153 178.542 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.06 175.5 0.2 Allowed 'General case' 0 N--CA 1.484 1.255 0 C-N-CA 124.402 1.081 . . . . 0.0 111.593 -172.053 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 45.7 m-20 70.54 132.39 0.04 OUTLIER Pre-proline 0 N--CA 1.489 1.507 0 C-N-CA 125.307 1.443 . . . . 0.0 112.024 173.739 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 66.6 Cg_exo -54.59 -43.79 55.66 Favored 'Trans proline' 0 C--N 1.377 2.043 0 C-N-CA 122.492 2.128 . . . . 0.0 110.922 167.727 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 40.58 48.43 3.91 Favored Glycine 0 C--N 1.36 1.866 0 O-C-N 125.324 1.64 . . . . 0.0 114.35 171.322 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.444 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 79.4 mtp180 -57.7 -47.81 81.31 Favored 'General case' 0 C--O 1.215 -0.756 0 C-N-CA 123.976 0.911 . . . . 0.0 112.472 -163.8 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.1 tt0 -69.17 -48.54 61.95 Favored 'General case' 0 N--CA 1.479 1.023 0 C-N-CA 123.272 0.629 . . . . 0.0 111.618 -174.873 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -59.18 -39.34 94.38 Favored Glycine 0 C--N 1.344 1.024 0 O-C-N 123.351 0.407 . . . . 0.0 113.683 175.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 34.1 m170 -77.77 -30.95 51.7 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 122.702 0.401 . . . . 0.0 110.209 -179.061 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.536 HD22 ' SG ' ' A' ' 44' ' ' CYS . 3.0 tm? -60.92 -46.99 88.48 Favored 'General case' 0 N--CA 1.476 0.84 0 C-N-CA 124.839 1.256 . . . . 0.0 109.529 173.419 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.672 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 21.0 tt0 -58.19 -51.6 69.07 Favored 'General case' 0 N--CA 1.467 0.378 0 C-N-CA 124.799 1.24 . . . . 0.0 110.352 177.835 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 19.7 mt-30 -63.95 -34.66 78.48 Favored 'General case' 0 N--CA 1.47 0.545 0 CA-C-N 115.298 -0.864 . . . . 0.0 110.68 -174.394 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 16.0 mmm180 -68.66 -46.15 69.88 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 123.078 0.551 . . . . 0.0 112.082 176.06 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 44.5 mt -59.33 -50.83 78.41 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.302 0 C-N-CA 122.753 0.421 . . . . 0.0 110.111 178.984 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 76.9 mt -64.87 -31.89 73.33 Favored 'General case' 0 CA--C 1.541 0.629 0 C-N-CA 123.317 0.647 . . . . 0.0 110.636 -177.512 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.474 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 22.1 tt0 -68.68 -47.95 65.17 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 123.103 0.561 . . . . 0.0 110.14 178.423 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 53.9 t -59.58 -36.61 66.04 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.01 0 C-N-CA 124.246 1.018 . . . . 0.0 110.848 179.16 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.585 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 89.1 mt -67.48 -40.29 85.28 Favored 'General case' 0 CA--C 1.55 0.957 0 CA-C-N 115.195 -0.911 . . . . 0.0 110.644 174.874 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 53.1 m -66.12 -48.04 72.15 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 124.015 0.926 . . . . 0.0 111.428 179.943 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.474 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 21.9 mm-40 -67.91 -38.94 83.57 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 123.457 0.703 . . . . 0.0 111.575 -174.471 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.28 -40.52 96.14 Favored 'General case' 0 C--O 1.237 0.444 0 CA-C-N 115.787 -0.642 . . . . 0.0 110.877 173.024 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.96 28.57 72.21 Favored Glycine 0 C--N 1.351 1.389 0 CA-C-N 115.442 -0.799 . . . . 0.0 112.057 -172.69 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 66.2 m -153.8 158.55 32.57 Favored Pre-proline 0 CA--C 1.549 0.931 0 C-N-CA 124.428 1.091 . . . . 0.0 109.029 -169.223 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 35.2 Cg_exo -60.49 122.03 10.66 Favored 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 122.219 1.946 . . . . 0.0 112.106 169.982 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 91.3 t -107.74 130.68 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 124.432 1.093 . . . . 0.0 108.756 -178.783 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.601 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.6 mttt -66.81 152.53 45.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 122.966 0.506 . . . . 0.0 110.837 179.174 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.498 ' O ' HG23 ' A' ' 41' ' ' VAL . 27.6 tp -59.72 -45.27 92.67 Favored 'General case' 0 N--CA 1.473 0.721 0 O-C-N 123.949 0.781 . . . . 0.0 109.817 174.221 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.33 -42.69 2.28 Favored 'General case' 0 N--CA 1.481 1.104 0 C-N-CA 124.909 1.283 . . . . 0.0 113.818 168.303 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 35.8 tt0 -84.68 -29.79 25.34 Favored 'General case' 0 N--CA 1.472 0.672 0 N-CA-C 110.328 -0.249 . . . . 0.0 110.328 -179.494 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 81.7 mt -62.64 -33.03 74.2 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 122.728 0.411 . . . . 0.0 110.201 177.9 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.512 ' HA ' HD11 ' A' ' 51' ' ' LEU . 42.8 t -59.46 -55.15 25.66 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.05 0 C-N-CA 123.56 0.744 . . . . 0.0 111.716 175.442 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 7.7 ptpp? -71.93 -39.58 69.35 Favored 'General case' 0 N--CA 1.476 0.831 0 CA-C-N 116.001 -0.545 . . . . 0.0 112.456 -174.777 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 27.9 mm-40 -67.32 -50.53 59.71 Favored 'General case' 0 N--CA 1.476 0.86 0 C-N-CA 122.947 0.499 . . . . 0.0 111.92 177.302 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.536 ' SG ' HD22 ' A' ' 20' ' ' LEU . 10.0 t -79.11 -12.85 60.01 Favored 'General case' 0 N--CA 1.48 1.048 0 C-N-CA 122.842 0.457 . . . . 0.0 110.911 -175.584 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 18.2 mm-40 61.78 28.97 17.84 Favored 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 124.818 1.247 . . . . 0.0 111.868 176.297 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -122.14 155.59 61.16 Favored Pre-proline 0 CA--C 1.544 0.749 0 C-N-CA 123.953 0.901 . . . . 0.0 111.367 -172.651 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.9 Cg_endo -64.64 129.44 23.63 Favored 'Trans proline' 0 C--N 1.381 2.28 0 C-N-CA 122.169 1.912 . . . . 0.0 111.548 177.167 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.528 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.9 ttmt -45.26 -41.01 8.09 Favored 'General case' 0 CA--C 1.555 1.159 0 C-N-CA 124.722 1.209 . . . . 0.0 113.027 175.961 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 4.4 tpp180 -54.14 -46.92 72.35 Favored 'General case' 0 N--CA 1.487 1.398 0 C-N-CA 124.269 1.027 . . . . 0.0 112.031 177.459 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 39.4 tt0 -66.5 -43.49 85.16 Favored 'General case' 0 C--O 1.243 0.739 0 CA-C-N 115.097 -0.956 . . . . 0.0 110.652 179.097 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.528 HD12 ' HA ' ' A' ' 48' ' ' LYS . 85.2 mt -56.83 -52.02 66.71 Favored 'General case' 0 C--N 1.358 0.974 0 O-C-N 124.227 0.954 . . . . 0.0 111.252 -179.427 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 11.7 m120 -48.47 -55.89 9.73 Favored 'General case' 0 N--CA 1.49 1.571 0 C-N-CA 124.625 1.17 . . . . 0.0 111.966 179.329 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.4 tp60 -60.56 -41.6 94.89 Favored 'General case' 0 CA--C 1.551 1.019 0 CA-C-N 115.478 -0.783 . . . . 0.0 111.79 -174.89 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 79.4 t -69.56 -44.11 79.95 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.96 0 C-N-CA 122.497 0.319 . . . . 0.0 110.299 177.397 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.401 HD13 ' NE1' ' A' ' 72' ' ' TRP . 35.4 mt -50.68 -49.49 57.21 Favored 'General case' 0 N--CA 1.482 1.153 0 C-N-CA 124.917 1.287 . . . . 0.0 113.254 178.857 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.428 ' O ' ' HG2' ' A' ' 60' ' ' LYS . 69.1 m-85 -70.4 -27.55 64.38 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 119.038 0.835 . . . . 0.0 111.33 -177.001 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 8.3 tmm_? -72.26 -44.74 62.39 Favored 'General case' 0 N--CA 1.474 0.742 0 C-N-CA 123.333 0.653 . . . . 0.0 109.496 177.519 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.672 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 71.5 mtm -64.49 -31.12 72.19 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.54 0.736 . . . . 0.0 111.217 173.537 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 55.6 tttm -66.61 -35.19 79.6 Favored 'General case' 0 N--CA 1.475 0.8 0 C-N-CA 124.17 0.988 . . . . 0.0 110.974 179.917 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.428 ' HG2' ' O ' ' A' ' 56' ' ' TYR . 74.3 mmtt -57.51 -36.8 72.02 Favored 'General case' 0 N--CA 1.479 1.001 0 C-N-CA 123.493 0.717 . . . . 0.0 111.14 170.932 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 29.4 mt-10 -90.55 5.1 49.2 Favored 'General case' 0 CA--C 1.549 0.933 0 C-N-CA 124.321 1.048 . . . . 0.0 111.174 -178.62 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 61.26 20.37 10.97 Favored 'General case' 0 N--CA 1.496 1.873 0 C-N-CA 125.484 1.514 . . . . 0.0 112.798 179.176 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.58 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 95.2 mttt -70.68 -38.96 73.79 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.703 0.801 . . . . 0.0 110.637 176.422 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.5 m -125.04 154.21 32.89 Favored 'Isoleucine or valine' 0 C--O 1.244 0.806 0 C-N-CA 123.778 0.831 . . . . 0.0 109.356 175.163 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 59.4 m -138.88 143.88 38.94 Favored 'General case' 0 CA--C 1.531 0.239 0 C-N-CA 124.405 1.082 . . . . 0.0 108.594 178.751 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 36.1 tp -98.22 105.14 17.25 Favored 'General case' 0 CA--C 1.543 0.683 0 N-CA-C 108.122 -1.066 . . . . 0.0 108.122 -173.548 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.8 p -87.25 -36.92 17.66 Favored 'General case' 0 N--CA 1.481 1.08 0 C-N-CA 123.706 0.802 . . . . 0.0 111.578 -173.635 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.541 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 27.7 m -137.14 163.79 46.68 Favored Pre-proline 0 CA--C 1.551 0.986 0 CA-C-O 117.526 -1.226 . . . . 0.0 107.709 -179.474 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.414 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 25.6 Cg_exo -20.37 -63.48 0.03 OUTLIER 'Trans proline' 0 C--N 1.399 3.205 1 C-N-CA 125.967 4.445 . . . . 0.0 116.785 -176.265 . . . . . . . . 3 3 . 1 . 004 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.77 10.39 8.97 Favored 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 123.228 0.611 . . . . 0.0 112.061 174.045 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.601 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 26.5 m -85.41 126.95 34.19 Favored 'General case' 0 N--CA 1.475 0.803 0 CA-C-O 120.87 0.366 . . . . 0.0 110.562 176.226 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.401 ' NE1' HD13 ' A' ' 55' ' ' LEU . 90.7 m95 -108.15 166.17 10.94 Favored 'General case' 0 N--CA 1.473 0.72 0 C-N-CA 124.549 1.14 . . . . 0.0 109.402 -177.865 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 47.4 t -150.17 157.22 42.87 Favored 'General case' 0 N--CA 1.471 0.595 0 N-CA-C 108.584 -0.895 . . . . 0.0 108.584 -179.481 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.585 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 29.3 tp -79.31 112.76 16.86 Favored 'General case' 0 C--O 1.238 0.499 0 N-CA-C 109.75 -0.463 . . . . 0.0 109.75 -179.383 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -67.32 -38.39 91.42 Favored Glycine 0 CA--C 1.528 0.871 0 O-C-N 123.816 0.698 . . . . 0.0 112.336 176.3 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -153.69 134.41 4.36 Favored Glycine 0 C--N 1.349 1.251 0 CA-C-O 119.536 -0.591 . . . . 0.0 111.959 179.395 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.526 ' HA ' HD21 ' A' ' 74' ' ' LEU . 27.8 m -71.94 122.28 20.54 Favored 'General case' 0 N--CA 1.474 0.739 0 C-N-CA 123.044 0.537 . . . . 0.0 109.853 178.018 . . . . . . . . 2 2 . 1 . 004 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 37.2 t70 -82.5 112.44 36.77 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 109.645 -0.502 . . . . 0.0 109.645 176.067 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 34.3 Cg_endo -88.4 -158.68 0.08 OUTLIER 'Trans proline' 0 C--N 1.373 1.859 0 C-N-CA 122.617 2.211 . . . . 0.0 110.765 177.685 . . . . . . . . 1 1 . 1 . 004 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 42.6 mt-10 . . . . . 0 C--O 1.251 1.171 0 N-CA-C 108.128 -1.064 . . . . 0.0 108.128 173.874 . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 60.2 mtt . . . . . 0 N--CA 1.479 0.981 0 N-CA-C 109.325 -0.62 . . . . 0.0 109.325 . . . . . . . . . 0 0 . 1 . 005 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -61.52 -22.1 61.08 Favored Glycine 0 C--N 1.355 1.59 0 O-C-N 123.633 0.583 . . . . 0.0 113.867 -177.293 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 52.7 t-80 -77.05 13.68 1.04 Allowed 'General case' 0 CA--C 1.56 1.328 0 C-N-CA 124.217 1.007 . . . . 0.0 111.692 177.003 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 16.1 p-80 -53.61 -52.24 60.47 Favored 'General case' 0 CA--C 1.548 0.87 0 C-N-CA 122.987 0.515 . . . . 0.0 110.801 172.872 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 76.1 t60 58.25 -1.93 0.09 Allowed 'General case' 0 N--CA 1.492 1.656 0 C-N-CA 125.246 1.418 . . . . 0.0 114.706 171.645 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 37.7 m80 -70.58 -23.61 62.62 Favored 'General case' 0 N--CA 1.48 1.028 0 C-N-CA 123.718 0.807 . . . . 0.0 111.794 -168.864 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -70.6 103.75 2.61 Favored 'General case' 0 CA--C 1.542 0.671 0 C-N-CA 123.115 0.566 . . . . 0.0 109.492 177.557 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 20.9 p-80 -164.97 41.56 0.08 Allowed 'General case' 0 N--CA 1.475 0.808 0 C-N-CA 124.121 0.969 . . . . 0.0 110.001 176.315 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 55.8 m -70.03 -15.12 62.97 Favored 'General case' 0 N--CA 1.481 1.108 0 CA-C-N 115.128 -0.942 . . . . 0.0 112.401 -179.64 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 81.9 t60 -78.58 -3.78 45.53 Favored 'General case' 0 N--CA 1.481 1.125 0 C-N-CA 123.344 0.658 . . . . 0.0 111.251 178.31 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.6 mtt -79.32 -1.8 38.51 Favored 'General case' 0 N--CA 1.476 0.832 0 O-C-N 122.084 -0.385 . . . . 0.0 111.558 172.109 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -162.25 89.19 0.69 Allowed 'General case' 0 C--N 1.35 0.602 0 C-N-CA 124.313 1.045 . . . . 0.0 109.925 174.41 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 22.3 p-10 -157.41 81.61 3.17 Favored Pre-proline 0 CA--C 1.553 1.087 0 C-N-CA 123.258 0.623 . . . . 0.0 111.304 178.788 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 43.2 Cg_endo -88.45 27.25 0.54 Allowed 'Trans proline' 0 C--N 1.377 2.055 0 C-N-CA 123.025 2.483 . . . . 0.0 112.968 179.089 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 55.73 -171.35 1.8 Allowed Glycine 0 N--CA 1.477 1.381 0 CA-C-N 115.597 -0.729 . . . . 0.0 113.735 -172.665 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.405 HH21 ' HG2' ' A' ' 50' ' ' GLU . 57.0 ttp180 -65.72 -10.07 33.46 Favored 'General case' 0 N--CA 1.485 1.284 0 C-N-CA 123.872 0.869 . . . . 0.0 113.049 165.081 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 36.2 tt0 -51.1 -51.18 55.88 Favored 'General case' 0 N--CA 1.484 1.24 0 N-CA-C 114.647 1.351 . . . . 0.0 114.647 -162.882 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.35 -27.88 73.35 Favored Glycine 0 N--CA 1.472 1.056 0 O-C-N 123.419 0.449 . . . . 0.0 114.008 178.273 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 77.9 t60 -75.74 -38.0 58.85 Favored 'General case' 0 N--CA 1.48 1.061 0 C-N-CA 123.617 0.767 . . . . 0.0 110.288 174.887 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.482 HD12 HG21 ' A' ' 54' ' ' VAL . 2.6 tm? -64.3 -41.63 96.77 Favored 'General case' 0 CA--C 1.54 0.582 0 C-N-CA 124.058 0.943 . . . . 0.0 109.976 175.154 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.436 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 43.0 tt0 -63.52 -40.61 97.49 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.123 0.969 . . . . 0.0 110.422 173.785 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.4 tp-100 -62.52 -36.97 84.26 Favored 'General case' 0 N--CA 1.475 0.79 0 CA-C-N 115.484 -0.78 . . . . 0.0 110.9 177.544 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.439 ' O ' HG23 ' A' ' 27' ' ' VAL . 1.3 mmp_? -62.07 -50.4 72.11 Favored 'General case' 0 N--CA 1.471 0.608 0 C-N-CA 123.193 0.597 . . . . 0.0 110.961 172.937 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.417 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.2 mt -56.64 -47.97 81.41 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.871 0 O-C-N 124.024 0.828 . . . . 0.0 110.442 -176.561 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.605 HD21 ' HB3' ' A' ' 63' ' ' LYS . 78.1 mt -60.54 -46.81 88.79 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.515 0.726 . . . . 0.0 111.57 178.997 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 6.3 tp-100 -66.21 -43.18 87.45 Favored 'General case' 0 CA--C 1.546 0.797 0 O-C-N 123.668 0.605 . . . . 0.0 111.116 -174.332 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.439 HG23 ' O ' ' A' ' 23' ' ' ARG . 70.9 t -61.02 -46.27 96.98 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.828 0 C-N-CA 123.443 0.697 . . . . 0.0 110.163 178.321 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.46 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.8 mt -66.81 -29.74 69.75 Favored 'General case' 0 CA--C 1.546 0.805 0 CA-C-N 115.068 -0.969 . . . . 0.0 111.677 -179.332 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.506 ' HA ' HD22 ' A' ' 74' ' ' LEU . 89.3 m -72.33 -49.77 31.93 Favored 'General case' 0 N--CA 1.473 0.723 0 C-N-CA 123.717 0.807 . . . . 0.0 111.725 176.632 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 42.7 mt-10 -67.81 -32.25 72.68 Favored 'General case' 0 N--CA 1.475 0.796 0 C-N-CA 123.107 0.563 . . . . 0.0 110.992 -176.228 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.75 -41.17 88.22 Favored 'General case' 0 CA--C 1.535 0.403 0 C-N-CA 123.312 0.645 . . . . 0.0 110.89 169.311 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.45 23.35 64.6 Favored Glycine 0 C--N 1.354 1.553 0 CA-C-N 115.546 -0.752 . . . . 0.0 111.941 -172.869 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.6 m -158.57 158.73 29.69 Favored Pre-proline 0 CA--C 1.553 1.064 0 C-N-CA 125.221 1.408 . . . . 0.0 109.091 -167.745 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.517 ' HA ' ' HA ' ' A' ' 73' ' ' CYS . 19.4 Cg_endo -60.34 128.32 25.81 Favored 'Trans proline' 0 C--N 1.373 1.855 0 C-N-CA 122.512 2.141 . . . . 0.0 112.253 172.94 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 93.8 t -106.54 140.07 25.89 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.564 0 C-N-CA 124.425 1.09 . . . . 0.0 108.201 175.609 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 60.8 mttp -74.46 157.97 34.65 Favored 'General case' 0 C--O 1.239 0.543 0 C-N-CA 123.5 0.72 . . . . 0.0 110.854 -179.303 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 34.3 tp -68.13 -44.9 75.05 Favored 'General case' 0 CA--C 1.535 0.4 0 C-N-CA 124.355 1.062 . . . . 0.0 111.068 -174.114 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.12 -34.83 10.42 Favored 'General case' 0 N--CA 1.483 1.2 0 N-CA-C 113.756 1.021 . . . . 0.0 113.756 168.969 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.482 ' HG2' ' HG2' ' A' ' 43' ' ' GLU . 49.6 tt0 -85.91 -29.45 23.62 Favored 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 109.64 -0.504 . . . . 0.0 109.64 -179.447 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 93.0 mt -63.93 -25.95 68.37 Favored 'General case' 0 N--CA 1.477 0.901 0 C-N-CA 122.677 0.391 . . . . 0.0 110.331 176.309 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.659 ' HA ' HD11 ' A' ' 51' ' ' LEU . 60.0 t -64.22 -51.43 68.65 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.841 0 C-N-CA 122.991 0.516 . . . . 0.0 110.474 176.608 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.2 ptmt -74.95 -47.16 30.9 Favored 'General case' 0 CA--C 1.547 0.837 0 O-C-N 123.603 0.565 . . . . 0.0 111.612 -176.18 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.482 ' HG2' ' HG2' ' A' ' 39' ' ' GLN . 46.5 mm-40 -61.54 -49.41 76.82 Favored 'General case' 0 N--CA 1.484 1.251 0 N-CA-C 112.345 0.498 . . . . 0.0 112.345 -179.347 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 59.1 m -82.1 -8.96 59.68 Favored 'General case' 0 N--CA 1.479 1.014 0 N-CA-C 112.215 0.45 . . . . 0.0 112.215 -177.314 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 24.8 mt-30 56.92 46.55 19.39 Favored 'General case' 0 N--CA 1.484 1.245 0 C-N-CA 124.698 1.199 . . . . 0.0 111.955 176.94 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -147.36 146.8 26.28 Favored Pre-proline 0 CA--C 1.539 0.54 0 CA-C-N 115.677 -0.692 . . . . 0.0 110.778 178.543 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -54.72 150.04 38.01 Favored 'Trans proline' 0 C--N 1.371 1.727 0 C-N-CA 123.116 2.544 . . . . 0.0 112.998 172.46 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.494 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.1 ttmt -50.29 -34.67 24.32 Favored 'General case' 0 CA--C 1.552 1.027 0 C-N-CA 124.86 1.264 . . . . 0.0 111.99 175.834 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 55.8 ttp180 -53.29 -48.93 67.95 Favored 'General case' 0 CA--C 1.552 1.045 0 C-N-CA 124.166 0.987 . . . . 0.0 112.009 174.829 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.405 ' HG2' HH21 ' A' ' 16' ' ' ARG . 1.9 mp0 -66.25 -47.05 75.01 Favored 'General case' 0 N--CA 1.476 0.868 0 CA-C-N 116.034 -0.53 . . . . 0.0 111.46 177.718 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.659 HD11 ' HA ' ' A' ' 41' ' ' VAL . 41.9 mt -59.84 -58.83 6.85 Favored 'General case' 0 C--O 1.203 -1.359 0 CA-C-N 115.15 -0.932 . . . . 0.0 111.572 -173.549 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 4.3 m-20 -52.66 -52.86 53.9 Favored 'General case' 0 N--CA 1.488 1.466 0 O-C-N 124.632 1.207 . . . . 0.0 112.074 -174.635 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 50.5 mt-30 -59.18 -37.07 76.48 Favored 'General case' 0 CA--C 1.545 0.782 0 O-C-N 124.028 0.83 . . . . 0.0 111.614 -178.248 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.482 HG21 HD12 ' A' ' 20' ' ' LEU . 87.9 t -73.09 -41.98 59.03 Favored 'Isoleucine or valine' 0 CA--C 1.553 1.077 0 N-CA-C 110.208 -0.293 . . . . 0.0 110.208 173.351 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 35.7 mt -59.7 -37.21 78.21 Favored 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.405 1.082 . . . . 0.0 113.693 -175.7 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 82.0 m-85 -73.21 -27.64 61.73 Favored 'General case' 0 N--CA 1.479 0.986 0 CA-C-N 118.652 0.66 . . . . 0.0 110.691 176.987 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.408 HH21 ' CD ' ' A' ' 21' ' ' GLU . 4.1 ptt180 -70.79 -44.97 65.53 Favored 'General case' 0 CA--C 1.543 0.681 0 N-CA-C 108.012 -1.107 . . . . 0.0 108.012 177.201 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.476 ' HB3' ' HB2' ' A' ' 63' ' ' LYS . 92.6 mtp -66.88 -37.88 85.25 Favored 'General case' 0 C--N 1.354 0.778 0 C-N-CA 124.419 1.088 . . . . 0.0 111.116 -178.435 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 26.3 ttpp -65.4 -38.62 90.51 Favored 'General case' 0 N--CA 1.473 0.689 0 C-N-CA 122.678 0.391 . . . . 0.0 110.338 178.599 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 25.3 ttpp -66.97 -27.63 67.61 Favored 'General case' 0 CA--C 1.552 1.027 0 CA-C-N 115.934 -0.575 . . . . 0.0 110.663 174.234 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.6 mt-10 -91.33 8.73 34.67 Favored 'General case' 0 N--CA 1.48 1.065 0 C-N-CA 123.983 0.913 . . . . 0.0 112.39 176.954 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.8 mm? 63.44 17.16 10.12 Favored 'General case' 0 N--CA 1.497 1.881 0 C-N-CA 123.806 0.842 . . . . 0.0 112.263 178.181 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.605 ' HB3' HD21 ' A' ' 25' ' ' LEU . 98.3 mttt -82.27 -34.91 28.54 Favored 'General case' 0 C--O 1.243 0.738 0 C-N-CA 124.124 0.97 . . . . 0.0 111.4 179.274 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.439 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 18.8 m -132.85 162.53 39.81 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.985 0 C-N-CA 123.227 0.611 . . . . 0.0 109.997 176.845 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.6 m -131.06 142.95 50.34 Favored 'General case' 0 C--O 1.219 -0.512 0 C-N-CA 123.411 0.684 . . . . 0.0 109.543 175.619 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 41.8 tp -92.51 101.08 13.52 Favored 'General case' 0 CA--C 1.541 0.615 0 N-CA-C 108.347 -0.983 . . . . 0.0 108.347 175.755 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 31.9 p -85.13 -37.25 20.44 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 123.835 0.854 . . . . 0.0 111.667 -177.766 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.513 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 15.9 t -140.32 155.1 70.3 Favored Pre-proline 0 CA--C 1.547 0.83 0 N-CA-C 106.399 -1.704 . . . . 0.0 106.399 -179.576 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 1.1 Cg_exo -26.84 -59.51 0.08 OUTLIER 'Trans proline' 0 C--N 1.386 2.52 1 C-N-CA 125.356 4.037 . . . . 0.0 116.865 179.887 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -120.05 42.06 3.03 Favored 'General case' 0 N--CA 1.48 1.025 0 C-N-CA 123.361 0.664 . . . . 0.0 111.178 176.542 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.513 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 34.1 m -131.95 126.7 34.69 Favored 'General case' 0 C--O 1.246 0.896 0 C-N-CA 123.239 0.616 . . . . 0.0 109.657 174.969 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.5 m95 -120.87 140.77 51.33 Favored 'General case' 0 C--O 1.225 -0.223 0 C-N-CA 124.228 1.011 . . . . 0.0 109.064 -172.842 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.517 ' HA ' ' HA ' ' A' ' 34' ' ' PRO . 50.8 t -117.9 162.74 17.63 Favored 'General case' 0 CA--C 1.511 -0.535 0 C-N-CA 123.833 0.853 . . . . 0.0 110.168 -175.962 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.506 HD22 ' HA ' ' A' ' 29' ' ' THR . 41.3 tp -69.78 105.69 2.85 Favored 'General case' 0 CA--C 1.533 0.298 0 N-CA-C 109.049 -0.723 . . . . 0.0 109.049 172.6 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.439 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . -77.12 -43.39 16.83 Favored Glycine 0 C--N 1.335 0.502 0 N-CA-C 110.401 -1.079 . . . . 0.0 110.401 171.723 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 169.86 113.65 0.29 Allowed Glycine 0 C--N 1.345 1.03 0 CA-C-N 115.031 -0.584 . . . . 0.0 112.172 176.806 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.534 ' HA ' HD22 ' A' ' 25' ' ' LEU . 86.4 m -66.16 97.02 0.36 Allowed 'General case' 0 C--O 1.242 0.681 0 N-CA-C 109.09 -0.707 . . . . 0.0 109.09 169.848 . . . . . . . . 2 2 . 1 . 005 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.5 t70 64.82 78.24 0.27 Allowed Pre-proline 0 CA--C 1.555 1.142 0 O-C-N 124.498 1.124 . . . . 0.0 109.483 -175.11 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 93.5 Cg_endo -75.49 159.4 39.62 Favored 'Trans proline' 0 C--N 1.382 2.3 0 C-N-CA 122.54 2.16 . . . . 0.0 112.786 -177.653 . . . . . . . . 1 1 . 1 . 005 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.2 mt-10 . . . . . 0 C--O 1.248 0.976 0 C-N-CA 123.995 0.918 . . . . 0.0 109.975 178.98 . . . . . . . . 0 0 . 1 . 006 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.406 ' SD ' ' N ' ' A' ' 2' ' ' GLY . 0.0 OUTLIER . . . . . 0 N--CA 1.482 1.159 0 N-CA-C 111.393 0.145 . . . . 0.0 111.393 . . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.406 ' N ' ' SD ' ' A' ' 1' ' ' MET . . . -111.94 -55.89 0.47 Allowed Glycine 0 C--N 1.352 1.437 0 N-CA-C 112.289 -0.325 . . . . 0.0 112.289 -176.596 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 51.2 t-80 -67.12 106.87 2.11 Favored 'General case' 0 N--CA 1.475 0.791 0 C-N-CA 124.071 0.948 . . . . 0.0 110.634 -178.193 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 53.1 t-80 63.15 52.22 2.56 Favored 'General case' 0 N--CA 1.479 1.023 0 O-C-N 124.321 1.013 . . . . 0.0 109.356 -174.716 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.0 p-80 -63.2 122.59 16.52 Favored 'General case' 0 N--CA 1.477 0.897 0 CA-C-N 114.895 -1.048 . . . . 0.0 111.314 -179.33 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 22.3 p-80 -95.43 -41.32 9.04 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 123.283 0.633 . . . . 0.0 109.988 174.28 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 38.0 m80 -142.03 153.36 44.18 Favored 'General case' 0 N--CA 1.478 0.935 0 C-N-CA 123.998 0.919 . . . . 0.0 109.004 178.015 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 26.8 p80 -76.07 87.74 2.98 Favored 'General case' 0 N--CA 1.48 1.04 0 CA-C-O 122.059 0.933 . . . . 0.0 109.583 175.715 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 43.1 t -152.64 139.15 18.64 Favored 'General case' 0 CA--C 1.535 0.401 0 C-N-CA 124.152 0.981 . . . . 0.0 110.401 -177.527 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 46.9 m80 -85.03 -77.25 0.29 Allowed 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.866 0.866 . . . . 0.0 109.348 174.219 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 67.1 mtt -147.45 -73.63 0.2 Allowed 'General case' 0 N--CA 1.484 1.266 0 C-N-CA 124.235 1.014 . . . . 0.0 108.413 176.305 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -98.5 -41.38 7.79 Favored 'General case' 0 N--CA 1.468 0.466 0 C-N-CA 124.039 0.936 . . . . 0.0 109.66 177.411 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.9 m-20 69.32 168.96 0.12 Allowed Pre-proline 0 N--CA 1.49 1.55 0 C-N-CA 124.679 1.192 . . . . 0.0 111.431 178.698 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 16.5 Cg_exo -69.55 11.75 0.36 Allowed 'Trans proline' 0 C--N 1.394 2.968 0 C-N-CA 122.933 2.422 . . . . 0.0 114.353 -175.499 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 63.22 158.71 0.18 Allowed Glycine 0 C--N 1.35 1.314 0 N-CA-C 114.459 0.543 . . . . 0.0 114.459 -172.023 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.476 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 99.7 mtt180 -62.1 -36.92 83.17 Favored 'General case' 0 C--O 1.215 -0.739 0 O-C-N 122.626 -0.337 . . . . 0.0 110.537 172.872 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -71.06 -45.8 63.12 Favored 'General case' 0 CA--C 1.54 0.587 0 O-C-N 123.717 0.636 . . . . 0.0 112.363 -177.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.09 -36.84 94.01 Favored Glycine 0 C--N 1.348 1.224 0 N-CA-C 113.747 0.259 . . . . 0.0 113.747 175.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.4 t-80 -71.58 -39.26 70.68 Favored 'General case' 0 N--CA 1.477 0.898 0 C-N-CA 122.68 0.392 . . . . 0.0 110.287 177.237 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.585 HD11 ' HA ' ' A' ' 51' ' ' LEU . 2.0 tm? -63.24 -46.5 86.64 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 124.758 1.223 . . . . 0.0 109.566 177.625 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 35.9 tt0 -63.51 -47.18 82.73 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 124.624 1.169 . . . . 0.0 110.306 -178.909 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 25.4 tp60 -63.21 -39.04 93.5 Favored 'General case' 0 C--N 1.349 0.562 0 CA-C-N 115.319 -0.855 . . . . 0.0 110.454 179.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.458 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.1 OUTLIER -64.59 -43.27 94.35 Favored 'General case' 0 CA--C 1.542 0.662 0 C-N-CA 123.0 0.52 . . . . 0.0 110.237 179.532 . . . . . . . . 3 3 . 1 . 006 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.402 HG13 ' O ' ' A' ' 20' ' ' LEU . 87.5 mt -58.43 -52.3 61.03 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.904 0 O-C-N 123.977 0.798 . . . . 0.0 110.076 177.04 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.543 HD21 ' HB3' ' A' ' 63' ' ' LYS . 96.0 mt -56.8 -38.45 72.58 Favored 'General case' 0 N--CA 1.483 1.219 0 C-N-CA 123.599 0.76 . . . . 0.0 111.01 -178.058 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.6 tt0 -65.17 -48.91 71.83 Favored 'General case' 0 CA--C 1.539 0.547 0 O-C-N 124.316 1.01 . . . . 0.0 110.99 -178.885 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.458 HG23 ' O ' ' A' ' 23' ' ' ARG . 93.5 t -57.55 -41.71 79.58 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.223 0 C-N-CA 123.596 0.758 . . . . 0.0 110.825 177.999 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.602 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 85.4 mt -63.95 -38.92 92.84 Favored 'General case' 0 CA--C 1.544 0.738 0 CA-C-N 114.788 -1.096 . . . . 0.0 110.953 179.552 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 29.2 m -69.69 -46.12 66.76 Favored 'General case' 0 C--N 1.353 0.751 0 C-N-CA 123.616 0.766 . . . . 0.0 111.495 -179.588 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.2 mt-10 -63.19 -38.31 90.65 Favored 'General case' 0 N--CA 1.483 1.194 0 C-N-CA 123.527 0.731 . . . . 0.0 110.942 -176.81 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.38 -44.19 83.78 Favored 'General case' 0 C--O 1.238 0.449 0 CA-C-N 115.545 -0.752 . . . . 0.0 110.509 171.593 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 20.19 66.89 Favored Glycine 0 C--N 1.353 1.52 0 CA-C-N 115.72 -0.673 . . . . 0.0 112.194 -173.053 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 54.9 p -159.92 153.79 19.48 Favored Pre-proline 0 CA--C 1.548 0.871 0 C-N-CA 124.915 1.286 . . . . 0.0 109.155 -168.647 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_exo -48.48 123.53 9.38 Favored 'Trans proline' 0 C--N 1.378 2.114 0 C-N-CA 123.65 2.9 . . . . 0.0 114.155 -178.368 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 94.3 t -108.51 129.73 62.42 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.415 0 C-N-CA 124.626 1.171 . . . . 0.0 108.611 -178.723 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.418 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 61.0 mttp -70.52 153.55 42.8 Favored 'General case' 0 N--CA 1.468 0.473 0 C-N-CA 122.994 0.518 . . . . 0.0 110.66 177.493 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.474 ' O ' HG23 ' A' ' 41' ' ' VAL . 53.5 tp -59.76 -48.11 83.0 Favored 'General case' 0 CA--C 1.542 0.662 0 O-C-N 123.885 0.74 . . . . 0.0 109.993 176.344 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.31 -41.64 19.56 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 124.576 1.15 . . . . 0.0 113.071 170.146 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.419 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 53.4 tt0 -73.29 -37.68 66.14 Favored 'General case' 0 N--CA 1.471 0.619 0 C-N-CA 122.933 0.493 . . . . 0.0 110.734 178.752 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 80.6 mt -59.41 -34.97 73.11 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.361 0.664 . . . . 0.0 110.466 178.257 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.474 HG23 ' O ' ' A' ' 37' ' ' LEU . 35.9 t -56.88 -56.64 13.4 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.036 0 C-N-CA 123.642 0.777 . . . . 0.0 111.711 176.365 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.1 pttp -69.29 -37.96 78.08 Favored 'General case' 0 N--CA 1.477 0.908 0 O-C-N 123.726 0.641 . . . . 0.0 111.735 -175.07 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.419 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 29.7 mm-40 -63.75 -55.82 20.28 Favored 'General case' 0 N--CA 1.474 0.75 0 C-N-CA 123.098 0.559 . . . . 0.0 111.911 177.015 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 41.8 t -76.95 -18.43 58.25 Favored 'General case' 0 N--CA 1.473 0.687 0 C-N-CA 122.778 0.431 . . . . 0.0 110.792 -174.457 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 45.2 mt-30 62.21 23.78 14.1 Favored 'General case' 0 N--CA 1.482 1.136 0 C-N-CA 124.942 1.297 . . . . 0.0 110.996 -179.129 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -117.19 153.15 49.77 Favored Pre-proline 0 CA--C 1.549 0.923 0 C-N-CA 124.554 1.142 . . . . 0.0 109.829 -175.461 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.487 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 10.5 Cg_endo -54.37 131.16 43.72 Favored 'Trans proline' 0 C--N 1.379 2.134 0 C-N-CA 123.032 2.488 . . . . 0.0 112.45 -179.986 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.7 ttmt -42.51 -44.89 4.28 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 125.168 1.387 . . . . 0.0 113.488 171.024 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.412 ' HG3' ' N ' ' A' ' 50' ' ' GLU . 47.7 ptt85 -57.66 -39.93 78.16 Favored 'General case' 0 N--CA 1.478 0.967 0 O-C-N 123.765 0.666 . . . . 0.0 111.829 178.687 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.487 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 6.2 tp10 -66.53 -49.38 66.69 Favored 'General case' 0 C--N 1.353 0.719 0 C-N-CA 123.566 0.746 . . . . 0.0 109.933 -178.568 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.585 ' HA ' HD11 ' A' ' 20' ' ' LEU . 22.3 mt -58.56 -57.21 13.95 Favored 'General case' 0 N--CA 1.471 0.611 0 CA-C-N 114.577 -1.192 . . . . 0.0 110.666 179.45 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.464 ' HA ' HD12 ' A' ' 55' ' ' LEU . 22.0 t-20 -50.47 -53.74 27.43 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 125.697 1.599 . . . . 0.0 112.402 -178.832 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 6.8 tp60 -58.0 -49.39 77.0 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.248 0.619 . . . . 0.0 111.702 -179.521 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.483 HG12 ' SD ' ' A' ' 58' ' ' MET . 70.3 t -63.91 -37.57 80.11 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 123.383 0.673 . . . . 0.0 110.675 -179.527 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.464 HD12 ' HA ' ' A' ' 52' ' ' ASN . 32.1 mt -54.08 -35.2 61.82 Favored 'General case' 0 N--CA 1.481 1.11 0 C-N-CA 124.441 1.096 . . . . 0.0 112.751 178.262 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 59.1 m-85 -69.93 -34.55 73.61 Favored 'General case' 0 N--CA 1.478 0.955 0 CA-C-N 118.466 0.576 . . . . 0.0 111.782 178.247 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 6.3 tpt180 -66.7 -49.25 66.68 Favored 'General case' 0 N--CA 1.48 1.072 0 N-CA-C 109.198 -0.668 . . . . 0.0 109.198 176.095 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.483 ' SD ' HG12 ' A' ' 54' ' ' VAL . 72.4 mtp -62.0 -36.01 80.23 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 124.263 1.025 . . . . 0.0 111.335 179.925 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 54.9 tttm -64.44 -39.58 94.09 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.943 0.897 . . . . 0.0 111.78 -178.842 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 88.5 mttt -67.72 -25.94 65.91 Favored 'General case' 0 N--CA 1.477 0.922 0 C-N-CA 123.316 0.646 . . . . 0.0 111.453 175.559 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 47.1 mt-10 -89.53 4.74 48.3 Favored 'General case' 0 N--CA 1.477 0.912 0 C-N-CA 123.56 0.744 . . . . 0.0 110.616 173.581 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.6 mm? 62.18 13.61 5.98 Favored 'General case' 0 N--CA 1.484 1.269 0 C-N-CA 125.136 1.375 . . . . 0.0 112.642 179.24 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.543 ' HB3' HD21 ' A' ' 25' ' ' LEU . 94.5 mttt -66.5 -39.45 88.71 Favored 'General case' 0 N--CA 1.483 1.205 0 C-N-CA 124.352 1.061 . . . . 0.0 110.431 178.112 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.1 m -125.47 160.78 31.13 Favored 'Isoleucine or valine' 0 C--O 1.243 0.741 0 CA-C-N 114.856 -1.065 . . . . 0.0 108.9 175.562 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.57 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 70.8 m -137.68 143.82 41.5 Favored 'General case' 0 C--N 1.329 -0.283 0 C-N-CA 123.995 0.918 . . . . 0.0 108.705 178.962 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.2 tp -96.6 101.0 12.54 Favored 'General case' 0 C--O 1.233 0.231 0 N-CA-C 106.367 -1.716 . . . . 0.0 106.367 179.235 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 5.0 t -92.94 -33.68 14.08 Favored 'General case' 0 N--CA 1.471 0.576 0 CA-C-N 115.578 -0.737 . . . . 0.0 111.014 -171.646 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.679 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 18.5 m -139.07 162.71 50.76 Favored Pre-proline 0 CA--C 1.555 1.147 0 C-N-CA 124.079 0.952 . . . . 0.0 108.717 178.745 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.3 Cg_exo -53.67 111.74 0.77 Allowed 'Trans proline' 0 C--N 1.381 2.25 0 C-N-CA 122.941 2.428 . . . . 0.0 113.281 178.441 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 63.79 26.37 14.37 Favored 'General case' 0 N--CA 1.48 1.05 0 C-N-CA 124.79 1.236 . . . . 0.0 111.538 -178.921 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.679 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 87.5 m -130.2 125.6 35.33 Favored 'General case' 0 C--O 1.244 0.768 0 C-N-CA 123.769 0.828 . . . . 0.0 108.927 178.785 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.9 m95 -113.46 171.28 7.66 Favored 'General case' 0 C--N 1.329 -0.308 0 C-N-CA 124.133 0.973 . . . . 0.0 109.449 -172.102 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.57 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 20.0 p -152.6 160.12 43.21 Favored 'General case' 0 C--O 1.237 0.419 0 C-N-CA 123.606 0.763 . . . . 0.0 109.008 177.868 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.602 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 26.1 tp -78.05 101.86 7.15 Favored 'General case' 0 C--O 1.238 0.479 0 N-CA-C 109.593 -0.521 . . . . 0.0 109.593 -179.563 . . . . . . . . 2 2 . 1 . 006 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -84.35 -39.62 8.98 Favored Glycine 0 C--N 1.341 0.806 0 N-CA-C 110.836 -0.906 . . . . 0.0 110.836 179.19 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -93.04 58.5 2.42 Favored Glycine 0 C--N 1.343 0.969 0 CA-C-N 114.811 -0.695 . . . . 0.0 111.472 177.131 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.2 t -75.86 88.57 2.87 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.029 0.932 . . . . 0.0 110.024 179.94 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 32.4 t70 51.5 73.51 0.96 Allowed Pre-proline 0 N--CA 1.48 1.04 0 C-N-CA 124.067 0.947 . . . . 0.0 110.59 -172.697 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 81.8 Cg_endo -77.35 148.54 26.85 Favored 'Trans proline' 0 C--N 1.37 1.663 0 C-N-CA 122.455 2.103 . . . . 0.0 112.27 -175.012 . . . . . . . . 1 1 . 1 . 006 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 47.4 mm-40 . . . . . 0 C--O 1.252 1.231 0 C-N-CA 123.468 0.707 . . . . 0.0 110.654 -179.128 . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 14.1 tpt . . . . . 0 N--CA 1.482 1.138 0 N-CA-C 109.376 -0.601 . . . . 0.0 109.376 . . . . . . . . . 0 0 . 1 . 007 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 87.57 83.55 1.19 Allowed Glycine 0 C--N 1.35 1.348 0 CA-C-N 116.32 -0.4 . . . . 0.0 112.645 176.526 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 72.9 m80 -57.61 -37.64 73.59 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 123.671 0.788 . . . . 0.0 110.782 178.018 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 11.7 m170 -81.18 99.44 8.56 Favored 'General case' 0 C--O 1.237 0.413 0 CA-C-N 115.101 -0.954 . . . . 0.0 108.579 173.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.1 m80 -70.45 119.8 15.16 Favored 'General case' 0 N--CA 1.471 0.576 0 C-N-CA 123.649 0.78 . . . . 0.0 109.928 -175.971 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -63.46 98.71 0.18 Allowed 'General case' 0 CA--C 1.549 0.91 0 C-N-CA 124.068 0.947 . . . . 0.0 110.732 -178.515 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 19.1 p-80 -141.17 106.23 4.98 Favored 'General case' 0 N--CA 1.478 0.931 0 N-CA-C 108.566 -0.901 . . . . 0.0 108.566 178.848 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 11.3 m170 55.58 37.57 29.06 Favored 'General case' 0 N--CA 1.481 1.09 0 C-N-CA 124.281 1.032 . . . . 0.0 110.172 -175.564 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.6 m -66.97 96.8 0.45 Allowed 'General case' 0 C--N 1.351 0.665 0 C-N-CA 124.195 0.998 . . . . 0.0 110.878 -178.632 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 64.8 t-80 -161.43 140.83 10.21 Favored 'General case' 0 C--O 1.237 0.409 0 N-CA-C 108.88 -0.785 . . . . 0.0 108.88 -178.064 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 58.2 mtm -77.32 116.26 17.77 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 108.743 -0.836 . . . . 0.0 108.743 177.552 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -64.82 97.19 0.21 Allowed 'General case' 0 N--CA 1.476 0.846 0 O-C-N 123.596 0.56 . . . . 0.0 110.258 -178.062 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.3 p-10 -73.86 139.64 77.05 Favored Pre-proline 0 C--O 1.241 0.653 0 CA-C-N 115.515 -0.766 . . . . 0.0 109.924 -177.934 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 55.9 Cg_endo -68.11 142.35 55.74 Favored 'Trans proline' 0 C--N 1.363 1.326 0 C-N-CA 122.048 1.832 . . . . 0.0 111.608 175.085 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -46.64 -78.02 0.09 OUTLIER Glycine 0 C--N 1.358 1.775 0 O-C-N 124.101 0.876 . . . . 0.0 115.132 -177.996 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 6.9 tpp180 -57.29 -59.85 4.5 Favored 'General case' 0 N--CA 1.471 0.595 0 CA-C-N 117.417 0.608 . . . . 0.0 111.784 176.924 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 30.6 tt0 -65.01 -53.31 48.17 Favored 'General case' 0 C--O 1.22 -0.472 0 CA-C-O 118.772 -0.633 . . . . 0.0 111.738 -166.16 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -56.69 -48.98 73.35 Favored Glycine 0 C--N 1.349 1.294 0 CA-C-O 119.858 -0.412 . . . . 0.0 114.091 179.492 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 19.5 m-70 -66.52 -47.34 73.23 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 122.989 0.515 . . . . 0.0 111.583 -176.821 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.628 HD12 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -63.36 -40.54 97.55 Favored 'General case' 0 CA--C 1.548 0.875 0 CA-C-N 115.106 -0.952 . . . . 0.0 110.853 -179.907 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.721 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.1 tt0 -61.83 -48.36 80.9 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.572 1.149 . . . . 0.0 110.354 177.737 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 86.9 mt-30 -57.76 -41.08 81.2 Favored 'General case' 0 N--CA 1.481 1.075 0 C-N-CA 123.484 0.713 . . . . 0.0 109.928 179.704 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.468 ' O ' HG23 ' A' ' 27' ' ' VAL . 20.2 mmm180 -68.28 -44.63 75.12 Favored 'General case' 0 C--N 1.352 0.695 0 C-N-CA 123.541 0.737 . . . . 0.0 112.398 -179.006 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.482 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 53.9 mt -59.83 -50.57 79.56 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.17 0 N-CA-C 109.612 -0.514 . . . . 0.0 109.612 178.137 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.444 ' HG ' ' O ' ' A' ' 21' ' ' GLU . 79.4 mt -63.92 -33.45 75.73 Favored 'General case' 0 N--CA 1.475 0.793 0 O-C-N 123.756 0.66 . . . . 0.0 110.744 -176.703 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 65.4 tt0 -69.09 -43.72 73.93 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.469 0.708 . . . . 0.0 110.594 178.556 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.468 HG23 ' O ' ' A' ' 23' ' ' ARG . 72.8 t -62.66 -34.94 68.12 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.91 0 C-N-CA 123.546 0.738 . . . . 0.0 110.537 178.199 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.482 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 78.3 mt -66.62 -37.34 84.65 Favored 'General case' 0 N--CA 1.479 1.005 0 CA-C-N 115.485 -0.78 . . . . 0.0 110.211 175.214 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 31.7 m -67.37 -52.72 36.65 Favored 'General case' 0 C--N 1.356 0.861 0 C-N-CA 124.193 0.997 . . . . 0.0 111.599 178.809 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.5 mm-40 -69.79 -31.46 69.4 Favored 'General case' 0 N--CA 1.477 0.892 0 C-N-CA 123.102 0.561 . . . . 0.0 111.7 -171.094 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.94 -38.34 90.64 Favored 'General case' 0 CA--C 1.543 0.702 0 CA-C-N 116.116 -0.493 . . . . 0.0 110.751 167.484 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.07 25.3 70.84 Favored Glycine 0 C--N 1.351 1.378 0 CA-C-N 115.631 -0.713 . . . . 0.0 112.521 -175.711 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 23.6 p -161.17 159.75 24.33 Favored Pre-proline 0 C--O 1.245 0.859 0 C-N-CA 125.25 1.42 . . . . 0.0 109.105 -172.421 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 51.9 Cg_exo -56.98 126.16 21.31 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 122.109 1.873 . . . . 0.0 112.773 174.726 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 89.3 t -104.03 138.38 28.83 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.627 0 C-N-CA 124.126 0.97 . . . . 0.0 108.663 -178.428 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 11.3 mptt -73.9 152.15 40.24 Favored 'General case' 0 N--CA 1.472 0.674 0 N-CA-C 109.131 -0.692 . . . . 0.0 109.131 179.548 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.418 ' O ' HG23 ' A' ' 41' ' ' VAL . 26.2 tp -61.86 -46.51 89.11 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.859 0.863 . . . . 0.0 109.846 178.067 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -41.45 -45.05 3.06 Favored 'General case' 0 CA--C 1.549 0.906 0 C-N-CA 124.902 1.281 . . . . 0.0 112.816 167.13 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.422 ' HG3' ' HE2' ' A' ' 42' ' ' LYS . 62.3 tt0 -79.79 -30.55 40.66 Favored 'General case' 0 N--CA 1.477 0.89 0 C-N-CA 122.911 0.484 . . . . 0.0 111.034 -178.802 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 87.1 mt -63.97 -30.82 71.87 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.161 0.584 . . . . 0.0 110.997 178.269 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.5 ' HA ' HD11 ' A' ' 51' ' ' LEU . 64.4 t -55.75 -56.35 12.87 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.304 0 C-N-CA 123.692 0.797 . . . . 0.0 112.024 176.887 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.422 ' HE2' ' HG3' ' A' ' 39' ' ' GLN . 63.2 pttt -68.85 -42.44 77.12 Favored 'General case' 0 N--CA 1.472 0.648 0 O-C-N 123.567 0.542 . . . . 0.0 111.668 -175.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 35.0 mm-40 -66.92 -49.39 65.68 Favored 'General case' 0 N--CA 1.469 0.524 0 C-N-CA 123.516 0.727 . . . . 0.0 112.089 -177.505 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 56.9 m -81.35 -9.94 59.64 Favored 'General case' 0 N--CA 1.473 0.715 0 C-N-CA 122.376 0.271 . . . . 0.0 110.805 -177.435 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.8 mt-30 60.13 29.49 19.05 Favored 'General case' 0 N--CA 1.487 1.419 0 C-N-CA 124.481 1.112 . . . . 0.0 111.401 175.87 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.7 156.06 65.45 Favored Pre-proline 0 N--CA 1.477 0.879 0 C-N-CA 123.525 0.73 . . . . 0.0 111.003 -173.844 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.8 Cg_endo -65.62 133.0 32.67 Favored 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.644 2.229 . . . . 0.0 111.938 174.275 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.0 ttmt -46.97 -36.69 8.01 Favored 'General case' 0 N--CA 1.481 1.087 0 C-N-CA 124.959 1.303 . . . . 0.0 113.072 174.91 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 46.0 mtm180 -54.6 -49.09 71.27 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 123.665 0.786 . . . . 0.0 110.957 175.439 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.5 tp10 -67.15 -46.96 72.49 Favored 'General case' 0 C--O 1.25 1.126 0 C-N-CA 123.891 0.876 . . . . 0.0 110.659 179.525 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.507 HD23 HD11 ' A' ' 20' ' ' LEU . 95.9 mt -53.68 -51.74 62.25 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 123.997 0.919 . . . . 0.0 111.496 -176.811 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 82.4 m-20 -53.47 -50.99 64.15 Favored 'General case' 0 N--CA 1.487 1.387 0 O-C-N 124.621 1.201 . . . . 0.0 112.444 -178.141 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 46.3 mt-30 -57.07 -39.88 75.81 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.993 0.808 . . . . 0.0 111.269 -178.863 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.628 HG21 HD12 ' A' ' 20' ' ' LEU . 98.2 t -71.49 -43.79 71.76 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.813 0 C-N-CA 123.567 0.747 . . . . 0.0 110.993 176.098 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.455 HD13 ' NE1' ' A' ' 72' ' ' TRP . 79.6 mt -54.04 -45.05 71.53 Favored 'General case' 0 N--CA 1.486 1.337 0 C-N-CA 124.474 1.109 . . . . 0.0 113.368 -179.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 83.8 m-85 -74.78 -25.4 59.04 Favored 'General case' 0 N--CA 1.48 1.055 0 CA-C-N 118.112 0.414 . . . . 0.0 111.534 -178.666 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 24.1 tpp180 -68.37 -53.52 23.4 Favored 'General case' 0 C--N 1.35 0.595 0 N-CA-C 109.424 -0.584 . . . . 0.0 109.424 172.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.721 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 68.7 mtm -60.79 -31.86 71.21 Favored 'General case' 0 N--CA 1.475 0.786 0 C-N-CA 123.995 0.918 . . . . 0.0 110.987 178.637 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 37.2 tttp -62.62 -46.81 86.55 Favored 'General case' 0 N--CA 1.473 0.695 0 C-N-CA 123.828 0.851 . . . . 0.0 110.861 175.94 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.415 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 4.9 ttmp? -68.18 -26.11 65.58 Favored 'General case' 0 CA--C 1.546 0.789 0 C-N-CA 123.443 0.697 . . . . 0.0 111.418 177.511 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 20.3 mm-40 -90.4 -0.0 57.46 Favored 'General case' 0 CA--C 1.549 0.919 0 C-N-CA 123.314 0.646 . . . . 0.0 111.516 177.127 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.7 mm? 67.75 10.99 8.16 Favored 'General case' 0 N--CA 1.498 1.947 0 C-N-CA 124.928 1.291 . . . . 0.0 112.845 178.021 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.532 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.1 mttt -69.51 -28.24 65.88 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 123.656 0.783 . . . . 0.0 111.04 174.285 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.7 m -134.0 161.23 41.22 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.172 0 C-N-CA 123.544 0.738 . . . . 0.0 110.048 171.822 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 49.7 m -139.08 152.21 47.34 Favored 'General case' 0 N--CA 1.47 0.56 0 C-N-CA 123.75 0.82 . . . . 0.0 108.876 172.814 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 48.7 tp -101.25 106.96 18.22 Favored 'General case' 0 CA--C 1.542 0.649 0 N-CA-C 108.897 -0.779 . . . . 0.0 108.897 -172.414 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 41.2 p -92.97 -39.79 10.92 Favored 'General case' 0 N--CA 1.475 0.813 0 C-N-CA 123.636 0.775 . . . . 0.0 111.178 -175.063 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.509 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 25.3 m -140.68 167.04 18.97 Favored Pre-proline 0 CA--C 1.556 1.19 0 C-N-CA 123.854 0.861 . . . . 0.0 109.249 -173.879 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 86.2 Cg_exo -49.71 112.43 0.69 Allowed 'Trans proline' 0 C--N 1.392 2.848 0 C-N-CA 123.124 2.549 . . . . 0.0 113.429 177.517 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 62.63 18.96 10.98 Favored 'General case' 0 N--CA 1.483 1.214 0 C-N-CA 124.372 1.069 . . . . 0.0 112.856 179.636 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.509 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 31.4 m -119.78 123.17 43.07 Favored 'General case' 0 C--O 1.243 0.739 0 C-N-CA 123.574 0.75 . . . . 0.0 110.0 -174.506 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.455 ' NE1' HD13 ' A' ' 55' ' ' LEU . 62.5 m95 -119.32 151.63 38.12 Favored 'General case' 0 N--CA 1.472 0.66 0 C-N-CA 124.339 1.055 . . . . 0.0 109.614 -169.841 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 24.4 p -128.22 157.03 41.98 Favored 'General case' 0 N--CA 1.474 0.74 0 C-N-CA 123.833 0.853 . . . . 0.0 109.337 175.446 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.428 HD23 ' OG1' ' A' ' 77' ' ' THR . 46.3 tp -77.61 131.19 37.68 Favored 'General case' 0 N--CA 1.477 0.877 0 C-N-CA 122.937 0.495 . . . . 0.0 110.839 -178.558 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -73.3 77.92 0.85 Allowed Glycine 0 C--N 1.349 1.281 0 N-CA-C 110.883 -0.887 . . . . 0.0 110.883 171.69 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 152.79 -23.67 0.82 Allowed Glycine 0 C--N 1.337 0.602 0 N-CA-C 110.926 -0.869 . . . . 0.0 110.926 -170.342 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.428 ' OG1' HD23 ' A' ' 74' ' ' LEU . 12.6 m -129.4 56.01 1.73 Allowed 'General case' 0 CA--C 1.548 0.895 0 N-CA-C 106.999 -1.482 . . . . 0.0 106.999 173.321 . . . . . . . . 2 2 . 1 . 007 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 2.4 m-20 -72.35 151.33 92.02 Favored Pre-proline 0 N--CA 1.485 1.295 0 CA-C-N 114.842 -1.072 . . . . 0.0 111.111 -177.139 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 45.8 Cg_exo -58.71 117.08 3.74 Favored 'Trans proline' 0 C--N 1.379 2.177 0 C-N-CA 122.93 2.42 . . . . 0.0 113.495 179.499 . . . . . . . . 1 1 . 1 . 007 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.4 tt0 . . . . . 0 C--O 1.254 1.293 0 N-CA-C 109.22 -0.659 . . . . 0.0 109.22 176.429 . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 26.7 ttt . . . . . 0 N--CA 1.485 1.311 0 N-CA-C 109.196 -0.668 . . . . 0.0 109.196 . . . . . . . . . 0 0 . 1 . 008 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -177.42 101.12 0.15 Allowed Glycine 0 C--N 1.347 1.145 0 C-N-CA 121.423 -0.418 . . . . 0.0 113.303 -178.647 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.0 m-70 -115.85 153.85 30.75 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 123.433 0.693 . . . . 0.0 109.525 173.414 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 60.9 t60 -71.35 106.96 4.07 Favored 'General case' 0 N--CA 1.469 0.505 0 C-N-CA 123.859 0.864 . . . . 0.0 109.467 178.022 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 96.3 m-70 -89.51 -58.15 2.63 Favored 'General case' 0 N--CA 1.474 0.773 0 O-C-N 123.591 0.557 . . . . 0.0 110.423 -178.838 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 72.2 t60 -119.44 124.4 46.43 Favored 'General case' 0 N--CA 1.474 0.749 0 C-N-CA 123.804 0.842 . . . . 0.0 110.477 -173.329 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 48.5 t60 -67.98 140.59 56.4 Favored 'General case' 0 N--CA 1.473 0.724 0 C-N-CA 124.411 1.084 . . . . 0.0 109.834 174.581 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.3 m80 -57.38 97.21 0.02 OUTLIER 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.486 0.715 . . . . 0.0 110.595 178.622 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 31.0 t -164.05 119.29 1.55 Allowed 'General case' 0 C--O 1.235 0.297 0 N-CA-C 106.966 -1.494 . . . . 0.0 106.966 -177.044 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 41.9 t-80 -62.26 98.27 0.11 Allowed 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 123.356 0.662 . . . . 0.0 110.91 -173.358 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 63.7 mtt 60.75 -83.76 0.02 OUTLIER 'General case' 0 CA--C 1.546 0.809 0 O-C-N 124.87 1.356 . . . . 0.0 110.521 -179.911 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 57.14 19.98 5.24 Favored 'General case' 0 N--CA 1.485 1.278 0 C-N-CA 124.594 1.157 . . . . 0.0 113.077 174.973 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 34.2 t70 -137.67 71.84 50.39 Favored Pre-proline 0 CA--C 1.547 0.863 0 C-N-CA 124.077 0.951 . . . . 0.0 108.58 -172.126 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 68.6 Cg_endo -90.15 -2.55 5.43 Favored 'Trans proline' 0 C--N 1.38 2.232 0 C-N-CA 123.35 2.7 . . . . 0.0 114.331 -174.087 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -47.15 -83.71 0.02 OUTLIER Glycine 0 C--N 1.352 1.43 0 N-CA-C 115.306 0.882 . . . . 0.0 115.306 177.809 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 31.8 mtm105 -54.86 -45.38 74.56 Favored 'General case' 0 N--CA 1.48 1.044 0 C-N-CA 123.893 0.877 . . . . 0.0 111.456 -176.259 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 39.6 tt0 -67.7 -46.04 73.39 Favored 'General case' 0 N--CA 1.47 0.531 0 O-C-N 124.645 1.215 . . . . 0.0 112.103 -171.936 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.32 -38.86 96.94 Favored Glycine 0 C--N 1.342 0.878 0 O-C-N 123.392 0.433 . . . . 0.0 113.012 176.398 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.5 m-70 -73.43 -36.21 65.9 Favored 'General case' 0 N--CA 1.479 0.991 0 CA-C-O 121.191 0.52 . . . . 0.0 110.52 -179.98 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.523 HD12 HG21 ' A' ' 54' ' ' VAL . 2.0 tm? -65.82 -42.53 90.49 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 124.304 1.042 . . . . 0.0 110.148 174.631 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 40.2 tt0 -61.35 -42.8 99.28 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 123.787 0.835 . . . . 0.0 109.898 177.655 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.3 OUTLIER -59.87 -42.54 93.92 Favored 'General case' 0 CA--C 1.54 0.581 0 CA-C-N 114.51 -1.223 . . . . 0.0 108.948 179.277 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.438 ' O ' HG23 ' A' ' 27' ' ' VAL . 12.7 tpt180 -67.16 -42.27 84.59 Favored 'General case' 0 CA--C 1.549 0.929 0 CA-C-N 115.383 -0.826 . . . . 0.0 111.137 -177.791 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 78.5 mt -57.01 -49.61 78.87 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.148 0 O-C-N 123.909 0.756 . . . . 0.0 109.876 176.796 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.602 HD21 ' HB3' ' A' ' 63' ' ' LYS . 92.0 mt -59.24 -39.59 83.25 Favored 'General case' 0 C--N 1.349 0.547 0 O-C-N 123.987 0.804 . . . . 0.0 111.142 -178.651 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 8.4 tt0 -66.62 -45.44 79.1 Favored 'General case' 0 CA--C 1.54 0.591 0 O-C-N 123.667 0.605 . . . . 0.0 110.911 -176.777 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.438 HG23 ' O ' ' A' ' 23' ' ' ARG . 86.6 t -56.34 -42.83 75.47 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.15 0 C-N-CA 123.289 0.636 . . . . 0.0 110.279 177.446 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 97.8 mt -71.9 -34.59 69.25 Favored 'General case' 0 CA--C 1.541 0.624 0 CA-C-N 115.122 -0.944 . . . . 0.0 111.635 -177.906 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.45 ' HA ' HD22 ' A' ' 74' ' ' LEU . 27.3 m -70.63 -45.65 64.81 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.314 0.646 . . . . 0.0 111.68 179.518 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.7 mt-10 -68.1 -33.17 74.03 Favored 'General case' 0 N--CA 1.476 0.867 0 C-N-CA 122.913 0.485 . . . . 0.0 110.867 -177.239 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -70.68 -44.88 66.11 Favored 'General case' 0 CA--C 1.537 0.454 0 O-C-N 123.705 0.628 . . . . 0.0 110.345 172.024 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.42 25.52 67.0 Favored Glycine 0 C--N 1.348 1.249 0 CA-C-N 115.738 -0.665 . . . . 0.0 111.782 -170.245 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 50.7 m -148.41 155.29 42.46 Favored Pre-proline 0 CA--C 1.543 0.697 0 C-N-CA 124.082 0.953 . . . . 0.0 110.314 -166.999 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 33.4 Cg_exo -60.53 109.21 0.61 Allowed 'Trans proline' 0 C--N 1.368 1.564 0 C-N-CA 123.063 2.509 . . . . 0.0 112.089 169.567 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.5 t -97.12 130.65 45.42 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.555 0 C-N-CA 123.991 0.916 . . . . 0.0 108.531 177.52 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 99.1 mttt -69.64 153.29 43.64 Favored 'General case' 0 N--CA 1.477 0.909 0 N-CA-C 109.81 -0.441 . . . . 0.0 109.81 179.041 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.483 ' O ' HG23 ' A' ' 41' ' ' VAL . 36.1 tp -59.18 -45.46 90.99 Favored 'General case' 0 N--CA 1.479 1.011 0 O-C-N 123.991 0.807 . . . . 0.0 110.23 -178.276 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.58 -47.27 10.29 Favored 'General case' 0 CA--C 1.546 0.818 0 C-N-CA 124.362 1.065 . . . . 0.0 112.94 170.213 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.436 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.9 tt0 -77.32 -34.89 55.27 Favored 'General case' 0 N--CA 1.471 0.598 0 C-N-CA 123.002 0.521 . . . . 0.0 110.397 -179.273 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 25.8 mt -56.76 -41.51 77.72 Favored 'General case' 0 N--CA 1.481 1.118 0 C-N-CA 123.618 0.767 . . . . 0.0 110.591 179.416 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 37' ' ' LEU . 92.1 t -53.59 -56.34 9.17 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.006 0 O-C-N 124.243 0.965 . . . . 0.0 111.635 -179.666 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.5 pttp -74.59 -35.18 62.99 Favored 'General case' 0 CA--C 1.542 0.649 0 CA-C-N 115.858 -0.61 . . . . 0.0 111.27 -170.943 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.436 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 13.7 mm-40 -69.98 -45.86 66.44 Favored 'General case' 0 N--CA 1.474 0.728 0 C-N-CA 122.713 0.405 . . . . 0.0 112.088 177.07 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.589 ' SG ' ' HB3' ' A' ' 46' ' ' ALA . 23.8 p -72.6 -19.66 61.43 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 122.399 0.279 . . . . 0.0 111.042 -179.621 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 48.3 mt-30 64.8 37.84 7.1 Favored 'General case' 0 C--N 1.361 1.079 0 C-N-CA 124.292 1.037 . . . . 0.0 110.106 -179.719 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.589 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -134.64 159.45 72.16 Favored Pre-proline 0 CA--C 1.548 0.872 0 CA-C-N 114.954 -1.021 . . . . 0.0 111.679 -173.213 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 62.8 Cg_endo -72.71 134.81 22.68 Favored 'Trans proline' 0 C--N 1.375 1.957 0 C-N-CA 122.426 2.084 . . . . 0.0 111.95 177.645 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -50.21 -31.84 14.95 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 124.669 1.188 . . . . 0.0 113.086 175.068 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.9 mmt180 -61.03 -48.64 80.84 Favored 'General case' 0 N--CA 1.481 1.089 0 C-N-CA 122.622 0.369 . . . . 0.0 111.183 177.957 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 12.4 tp10 -65.86 -46.61 77.8 Favored 'General case' 0 C--O 1.242 0.691 0 O-C-N 123.772 0.67 . . . . 0.0 110.55 179.57 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.569 HD21 ' SG ' ' A' ' 44' ' ' CYS . 93.8 mt -55.06 -58.61 6.95 Favored 'General case' 0 N--CA 1.476 0.868 0 O-C-N 124.267 0.98 . . . . 0.0 110.746 179.966 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 22.9 t-20 -48.13 -53.24 17.35 Favored 'General case' 0 N--CA 1.477 0.885 0 C-N-CA 125.658 1.583 . . . . 0.0 112.216 -174.497 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 20.9 mt-30 -56.52 -48.83 76.4 Favored 'General case' 0 N--CA 1.482 1.15 0 O-C-N 123.945 0.778 . . . . 0.0 112.423 177.692 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.585 HG12 ' SD ' ' A' ' 58' ' ' MET . 70.1 t -63.63 -43.73 98.26 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.601 0 O-C-N 123.734 0.647 . . . . 0.0 110.726 -178.547 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 77.0 mt -50.7 -43.9 57.9 Favored 'General case' 0 N--CA 1.471 0.613 0 C-N-CA 125.237 1.415 . . . . 0.0 113.739 -177.335 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.459 ' O ' ' HG3' ' A' ' 60' ' ' LYS . 92.5 m-85 -73.1 -30.92 64.0 Favored 'General case' 0 N--CA 1.48 1.052 0 CA-C-N 118.508 0.595 . . . . 0.0 112.21 -178.985 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.4 ttt85 -74.02 -51.99 14.13 Favored 'General case' 0 N--CA 1.478 0.954 0 C-N-CA 122.443 0.297 . . . . 0.0 110.209 179.04 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.585 ' SD ' HG12 ' A' ' 54' ' ' VAL . 19.7 ptm -65.82 -19.26 65.82 Favored 'General case' 0 CA--C 1.546 0.808 0 C-N-CA 123.137 0.575 . . . . 0.0 110.812 178.896 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 60.7 tttm -65.46 -44.31 87.6 Favored 'General case' 0 N--CA 1.479 0.978 0 C-N-CA 123.555 0.742 . . . . 0.0 110.759 171.49 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.459 ' HG3' ' O ' ' A' ' 56' ' ' TYR . 61.3 mttm -66.35 -31.68 72.61 Favored 'General case' 0 N--CA 1.475 0.822 0 C-N-CA 123.637 0.775 . . . . 0.0 110.826 178.736 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 40.8 mt-10 -84.45 6.24 24.19 Favored 'General case' 0 CA--C 1.544 0.712 0 CA-C-N 114.796 -1.093 . . . . 0.0 111.227 178.613 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 4.3 mm? 65.81 10.93 7.24 Favored 'General case' 0 N--CA 1.492 1.653 0 C-N-CA 124.872 1.269 . . . . 0.0 112.305 176.441 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.602 ' HB3' HD21 ' A' ' 25' ' ' LEU . 92.3 mttt -70.85 -34.97 72.19 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.586 0.754 . . . . 0.0 110.505 179.375 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.509 HG22 ' HG3' ' A' ' 58' ' ' MET . 16.4 m -133.64 160.33 42.19 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.123 0 C-N-CA 123.289 0.635 . . . . 0.0 109.731 174.409 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 39.1 m -125.45 150.6 47.17 Favored 'General case' 0 N--CA 1.462 0.163 0 N-CA-C 108.282 -1.007 . . . . 0.0 108.282 175.08 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 52.5 tp -104.49 104.67 14.56 Favored 'General case' 0 N--CA 1.467 0.421 0 N-CA-C 107.152 -1.425 . . . . 0.0 107.152 175.766 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 44.1 p -87.73 -42.75 12.4 Favored 'General case' 0 CA--C 1.54 0.584 0 C-N-CA 123.73 0.812 . . . . 0.0 110.896 -172.654 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.502 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 30.7 m -139.84 170.63 9.41 Favored Pre-proline 0 CA--C 1.552 1.034 0 C-N-CA 124.035 0.934 . . . . 0.0 109.486 -174.476 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 62.1 Cg_exo -43.32 106.49 0.08 OUTLIER 'Trans proline' 0 C--N 1.383 2.348 0 C-N-CA 123.418 2.746 . . . . 0.0 114.071 173.714 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.04 20.0 10.46 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 124.765 1.226 . . . . 0.0 112.626 178.688 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.502 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 34.6 m -114.64 118.47 33.76 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 123.61 0.764 . . . . 0.0 109.153 -174.84 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 58.3 m95 -116.92 139.15 50.98 Favored 'General case' 0 N--CA 1.464 0.247 0 C-N-CA 123.948 0.899 . . . . 0.0 109.314 -169.572 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 45.8 t -117.38 165.08 13.92 Favored 'General case' 0 N--CA 1.474 0.762 0 C-N-CA 123.029 0.532 . . . . 0.0 109.902 175.971 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.45 HD22 ' HA ' ' A' ' 29' ' ' THR . 45.5 tp -65.93 111.64 3.41 Favored 'General case' 0 CA--C 1.544 0.737 0 C-N-CA 122.969 0.508 . . . . 0.0 110.112 176.754 . . . . . . . . 2 2 . 1 . 008 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -80.6 -40.67 12.25 Favored Glycine 0 N--CA 1.465 0.57 0 N-CA-C 111.447 -0.661 . . . . 0.0 111.447 175.303 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -89.91 83.75 1.37 Allowed Glycine 0 C--N 1.343 0.926 0 CA-C-O 119.721 -0.488 . . . . 0.0 111.963 179.646 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 32.5 m -56.89 100.79 0.05 OUTLIER 'General case' 0 CA--C 1.549 0.927 0 C-N-CA 123.698 0.799 . . . . 0.0 111.42 -178.687 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.4 m-20 -62.18 129.24 91.99 Favored Pre-proline 0 N--CA 1.472 0.674 0 C-N-CA 123.311 0.645 . . . . 0.0 110.857 177.8 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 84.9 Cg_endo -78.43 44.46 1.63 Allowed 'Trans proline' 0 C--N 1.368 1.6 0 C-N-CA 123.036 2.49 . . . . 0.0 112.759 177.119 . . . . . . . . 1 1 . 1 . 008 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 37.0 tt0 . . . . . 0 CA--C 1.557 1.242 0 C-N-CA 124.35 1.06 . . . . 0.0 109.559 -177.734 . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.2 mpt? . . . . . 0 N--CA 1.487 1.378 0 N-CA-C 109.421 -0.585 . . . . 0.0 109.421 . . . . . . . . . 0 0 . 1 . 009 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -101.87 32.14 7.87 Favored Glycine 0 C--N 1.347 1.175 0 O-C-N 123.315 0.385 . . . . 0.0 113.141 178.523 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 32.1 m170 -82.13 -32.03 30.31 Favored 'General case' 0 N--CA 1.482 1.156 0 C-N-CA 123.215 0.606 . . . . 0.0 111.476 -177.474 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 44.2 m80 69.17 20.83 7.45 Favored 'General case' 0 N--CA 1.491 1.576 0 C-N-CA 124.956 1.302 . . . . 0.0 111.36 -174.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 73.0 t60 -97.85 87.23 3.95 Favored 'General case' 0 CA--C 1.543 0.683 0 C-N-CA 123.509 0.723 . . . . 0.0 109.406 -177.9 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.0 m170 -113.68 105.62 13.52 Favored 'General case' 0 N--CA 1.478 0.941 0 C-N-CA 123.787 0.835 . . . . 0.0 109.872 178.594 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 4.0 t60 -157.07 140.96 16.14 Favored 'General case' 0 CA--C 1.543 0.685 0 N-CA-C 107.541 -1.281 . . . . 0.0 107.541 176.289 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 48.9 t-80 -58.16 -33.62 69.4 Favored 'General case' 0 N--CA 1.48 1.056 0 N-CA-C 113.232 0.827 . . . . 0.0 113.232 -174.037 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 29.9 p -74.96 77.76 2.18 Favored 'General case' 0 CA--C 1.546 0.799 0 C-N-CA 122.956 0.502 . . . . 0.0 111.306 179.382 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 19.3 p80 -73.19 75.62 1.29 Allowed 'General case' 0 N--CA 1.481 1.076 0 C-N-CA 123.752 0.821 . . . . 0.0 109.196 176.463 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 48.6 ttm 66.38 -70.92 0.1 Allowed 'General case' 0 N--CA 1.477 0.918 0 C-N-CA 124.919 1.287 . . . . 0.0 108.572 -160.906 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -169.28 152.75 5.05 Favored 'General case' 0 C--O 1.238 0.455 0 C-N-CA 124.433 1.093 . . . . 0.0 109.661 174.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 19.3 m-20 -72.78 143.5 84.62 Favored Pre-proline 0 N--CA 1.478 0.929 0 N-CA-C 107.99 -1.115 . . . . 0.0 107.99 165.508 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 23.6 Cg_exo -64.67 80.45 0.18 Allowed 'Trans proline' 0 C--N 1.376 2.006 0 C-N-CA 123.074 2.516 . . . . 0.0 113.019 -175.773 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -28.65 95.46 0.01 OUTLIER Glycine 0 C--N 1.357 1.731 0 C-N-CA 125.566 1.555 . . . . 0.0 114.813 176.502 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 59.0 mtm180 -52.97 -12.04 0.29 Allowed 'General case' 0 N--CA 1.474 0.762 0 N-CA-C 116.136 1.902 . . . . 0.0 116.136 -170.71 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.6 tt0 -51.95 -52.66 48.77 Favored 'General case' 0 N--CA 1.477 0.891 0 C-N-CA 124.186 0.994 . . . . 0.0 112.769 -163.806 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -62.34 -41.4 99.75 Favored Glycine 0 C--N 1.351 1.378 0 N-CA-C 115.586 0.994 . . . . 0.0 115.586 177.623 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 18.1 t60 -69.21 -45.65 69.36 Favored 'General case' 0 N--CA 1.488 1.435 0 N-CA-C 108.92 -0.77 . . . . 0.0 108.92 -177.231 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.564 HD11 HD23 ' A' ' 51' ' ' LEU . 2.6 tm? -64.69 -37.26 86.98 Favored 'General case' 0 CA--C 1.541 0.62 0 CA-C-N 113.69 -1.595 . . . . 0.0 110.125 -179.329 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.1 tt0 -60.91 -50.85 71.76 Favored 'General case' 0 N--CA 1.471 0.594 0 C-N-CA 124.235 1.014 . . . . 0.0 110.461 175.792 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 95.5 mt-30 -62.62 -31.87 72.79 Favored 'General case' 0 N--CA 1.471 0.583 0 O-C-N 124.617 1.198 . . . . 0.0 110.559 -179.541 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 15.9 tpt180 -71.35 -44.11 65.68 Favored 'General case' 0 CA--C 1.544 0.712 0 C-N-CA 123.11 0.564 . . . . 0.0 111.311 179.194 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.427 HD12 ' HE3' ' A' ' 58' ' ' MET . 79.5 mt -60.53 -47.41 92.84 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.033 0 N-CA-C 109.684 -0.487 . . . . 0.0 109.684 177.094 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 94.6 mt -58.67 -36.05 73.54 Favored 'General case' 0 C--N 1.357 0.923 0 C-N-CA 123.678 0.791 . . . . 0.0 110.66 178.529 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 40.3 tt0 -65.45 -48.71 71.78 Favored 'General case' 0 C--N 1.351 0.673 0 O-C-N 124.034 0.834 . . . . 0.0 110.599 179.619 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 71.4 t -58.56 -39.42 75.52 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.03 0 C-N-CA 123.883 0.873 . . . . 0.0 110.752 179.248 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 65.6 mt -68.46 -38.89 81.5 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.994 -1.003 . . . . 0.0 111.098 178.869 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 67.5 m -72.18 -45.69 59.38 Favored 'General case' 0 N--CA 1.476 0.864 0 C-N-CA 123.526 0.73 . . . . 0.0 111.991 -179.89 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -65.16 -38.76 91.58 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.042 0.537 . . . . 0.0 110.969 -176.525 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.85 -39.83 83.75 Favored 'General case' 0 CA--C 1.543 0.686 0 CA-C-N 115.799 -0.637 . . . . 0.0 110.414 171.313 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 67.2 22.53 72.72 Favored Glycine 0 C--N 1.353 1.49 0 CA-C-N 115.429 -0.805 . . . . 0.0 112.322 -175.584 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 76.1 p -151.39 166.73 14.49 Favored Pre-proline 0 C--O 1.246 0.901 0 C-N-CA 123.999 0.92 . . . . 0.0 109.697 -169.76 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 39.1 Cg_exo -58.18 118.51 5.41 Favored 'Trans proline' 0 C--N 1.375 1.931 0 C-N-CA 122.424 2.083 . . . . 0.0 111.918 171.345 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 99.1 t -102.5 125.29 56.8 Favored 'Isoleucine or valine' 0 C--O 1.241 0.646 0 N-CA-C 107.875 -1.157 . . . . 0.0 107.875 175.614 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.52 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 67.2 mttm -69.52 155.08 41.04 Favored 'General case' 0 N--CA 1.469 0.509 0 C-N-CA 122.981 0.512 . . . . 0.0 110.523 179.148 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.429 ' O ' HG23 ' A' ' 41' ' ' VAL . 33.4 tp -61.19 -49.75 75.92 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.419 0.688 . . . . 0.0 110.726 179.548 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.83 -38.37 15.81 Favored 'General case' 0 N--CA 1.475 0.79 0 C-N-CA 123.841 0.857 . . . . 0.0 112.578 171.439 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.465 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 62.5 tt0 -75.36 -38.88 59.81 Favored 'General case' 0 CA--C 1.549 0.918 0 C-N-CA 122.795 0.438 . . . . 0.0 110.574 176.785 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 56.8 mt -56.98 -40.59 76.81 Favored 'General case' 0 N--CA 1.482 1.157 0 C-N-CA 123.422 0.689 . . . . 0.0 110.641 -179.241 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.429 HG23 ' O ' ' A' ' 37' ' ' LEU . 51.7 t -55.22 -54.07 28.4 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.0 0 O-C-N 123.962 0.789 . . . . 0.0 111.639 179.226 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 8.5 ptpp? -69.53 -39.01 77.75 Favored 'General case' 0 N--CA 1.479 0.978 0 O-C-N 123.241 0.338 . . . . 0.0 111.375 -176.53 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.465 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 46.6 mm-40 -64.35 -53.67 45.06 Favored 'General case' 0 N--CA 1.48 1.034 0 N-CA-C 112.97 0.73 . . . . 0.0 112.97 179.838 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.631 ' SG ' HD21 ' A' ' 51' ' ' LEU . 31.6 p -76.92 -24.45 52.44 Favored 'General case' 0 N--CA 1.477 0.904 0 C-N-CA 122.721 0.408 . . . . 0.0 111.132 -175.0 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 26.0 mm-40 63.3 36.61 11.6 Favored 'General case' 0 N--CA 1.488 1.436 0 C-N-CA 124.107 0.963 . . . . 0.0 110.919 -174.87 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.429 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -118.81 150.47 48.51 Favored Pre-proline 0 C--O 1.242 0.697 0 CA-C-N 115.143 -0.935 . . . . 0.0 110.394 178.819 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 36.2 Cg_endo -65.08 135.84 45.5 Favored 'Trans proline' 0 C--N 1.372 1.8 0 C-N-CA 122.207 1.938 . . . . 0.0 111.437 177.52 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.8 ttmt -50.02 -33.28 17.58 Favored 'General case' 0 CA--C 1.551 0.999 0 C-N-CA 124.683 1.193 . . . . 0.0 112.64 176.348 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.6 mtm180 -61.54 -45.06 95.77 Favored 'General case' 0 N--CA 1.484 1.235 0 C-N-CA 123.581 0.752 . . . . 0.0 111.74 176.898 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 9.6 tp10 -65.0 -50.16 67.37 Favored 'General case' 0 N--CA 1.48 1.032 0 C-N-CA 123.618 0.767 . . . . 0.0 110.387 174.173 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.631 HD21 ' SG ' ' A' ' 44' ' ' CYS . 97.0 mt -53.95 -58.89 5.63 Favored 'General case' 0 C--N 1.358 0.957 0 C-N-CA 124.201 1.0 . . . . 0.0 112.01 -176.896 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.453 ' HA ' HD12 ' A' ' 55' ' ' LEU . 5.3 m-20 -55.7 -46.43 77.68 Favored 'General case' 0 N--CA 1.483 1.221 0 O-C-N 124.554 1.159 . . . . 0.0 111.953 -173.941 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 36.0 tt0 -54.08 -48.82 70.25 Favored 'General case' 0 CA--C 1.544 0.735 0 O-C-N 123.853 0.721 . . . . 0.0 110.691 177.693 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.486 HG21 HD12 ' A' ' 20' ' ' LEU . 56.9 t -70.15 -36.08 66.34 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.988 0 CA-C-N 116.418 -0.355 . . . . 0.0 111.101 179.707 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.453 HD12 ' HA ' ' A' ' 52' ' ' ASN . 57.7 mt -53.55 -42.92 68.01 Favored 'General case' 0 N--CA 1.481 1.123 0 C-N-CA 124.437 1.095 . . . . 0.0 113.649 177.616 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 56.6 m-85 -72.62 -27.17 61.99 Favored 'General case' 0 N--CA 1.476 0.859 0 CA-C-N 118.681 0.673 . . . . 0.0 111.405 177.552 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.9 ttt85 -67.35 -58.58 4.54 Favored 'General case' 0 N--CA 1.472 0.634 0 C-N-CA 123.662 0.785 . . . . 0.0 110.473 176.01 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.545 ' SD ' HG11 ' A' ' 64' ' ' VAL . 14.4 ptp -61.56 -28.73 69.54 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 123.724 0.81 . . . . 0.0 111.561 179.577 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 63.0 tttm -65.89 -43.71 87.46 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.534 0.734 . . . . 0.0 110.963 173.756 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.425 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 5.0 ttmp? -63.35 -39.24 94.0 Favored 'General case' 0 N--CA 1.472 0.669 0 C-N-CA 123.716 0.806 . . . . 0.0 111.008 174.638 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 23.2 mm-40 -82.78 4.15 26.46 Favored 'General case' 0 N--CA 1.472 0.627 0 CA-C-N 115.799 -0.637 . . . . 0.0 111.231 178.071 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 57.6 mt 63.03 15.04 8.11 Favored 'General case' 0 C--N 1.358 0.977 0 C-N-CA 125.365 1.466 . . . . 0.0 112.553 171.878 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . . . . . . . . . 98.6 mttt -72.72 -23.15 60.81 Favored 'General case' 0 C--N 1.348 0.518 0 C-N-CA 124.411 1.084 . . . . 0.0 110.433 175.85 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.545 HG11 ' SD ' ' A' ' 58' ' ' MET . 13.3 m -130.52 170.09 20.11 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.748 0 C-N-CA 123.115 0.566 . . . . 0.0 109.933 171.386 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 30.8 t -135.0 153.37 52.11 Favored 'General case' 0 C--O 1.24 0.554 0 CA-C-N 114.718 -1.128 . . . . 0.0 108.345 173.277 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 38.0 tp -101.25 101.82 12.58 Favored 'General case' 0 C--O 1.239 0.522 0 N-CA-C 107.24 -1.393 . . . . 0.0 107.24 176.148 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 25.4 p -81.52 -41.68 21.34 Favored 'General case' 0 N--CA 1.474 0.76 0 C-N-CA 122.965 0.506 . . . . 0.0 110.444 -176.165 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.544 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 42.3 t -140.21 152.3 66.78 Favored Pre-proline 0 CA--C 1.546 0.823 0 C-N-CA 123.644 0.778 . . . . 0.0 108.915 179.275 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 75.8 Cg_exo -47.16 124.37 8.9 Favored 'Trans proline' 0 C--N 1.374 1.869 0 C-N-CA 123.135 2.557 . . . . 0.0 112.431 168.378 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 69.31 9.53 7.36 Favored 'General case' 0 N--CA 1.484 1.274 0 C-N-CA 125.155 1.382 . . . . 0.0 112.715 -179.174 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.544 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 58.3 m -129.02 120.04 25.32 Favored 'General case' 0 CA--C 1.539 0.52 0 C-N-CA 123.64 0.776 . . . . 0.0 109.264 -179.456 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 79.3 m95 -107.15 166.81 10.35 Favored 'General case' 0 N--CA 1.468 0.474 0 C-N-CA 123.732 0.813 . . . . 0.0 108.867 -176.845 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 42.3 t -152.82 165.13 36.35 Favored 'General case' 0 N--CA 1.471 0.6 0 N-CA-C 108.483 -0.932 . . . . 0.0 108.483 179.26 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.452 HD23 ' O ' ' A' ' 77' ' ' THR . 22.3 tp -71.12 148.39 47.47 Favored 'General case' 0 CA--C 1.544 0.713 0 N-CA-C 110.178 -0.304 . . . . 0.0 110.178 176.711 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.27 85.77 0.24 Allowed Glycine 0 C--N 1.347 1.14 0 O-C-N 123.497 0.498 . . . . 0.0 112.256 -179.342 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 110.21 -7.77 30.84 Favored Glycine 0 N--CA 1.461 0.316 0 N-CA-C 111.717 -0.553 . . . . 0.0 111.717 179.208 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.452 ' O ' HD23 ' A' ' 74' ' ' LEU . 31.4 m 68.25 -55.45 0.51 Allowed 'General case' 0 C--N 1.36 1.022 0 C-N-CA 125.947 1.699 . . . . 0.0 110.878 -171.069 . . . . . . . . 2 2 . 1 . 009 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 17.9 m-20 -121.26 96.46 48.09 Favored Pre-proline 0 CA--C 1.546 0.8 0 N-CA-C 107.087 -1.449 . . . . 0.0 107.087 166.666 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 44.3 Cg_exo -58.16 157.08 26.77 Favored 'Trans proline' 0 C--N 1.374 1.91 0 C-N-CA 123.519 2.813 . . . . 0.0 114.562 -174.956 . . . . . . . . 1 1 . 1 . 009 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 36.9 tt0 . . . . . 0 C--O 1.251 1.155 0 N-CA-C 108.175 -1.046 . . . . 0.0 108.175 179.374 . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 78.1 mtm . . . . . 0 N--CA 1.48 1.059 0 CA-C-O 120.193 0.044 . . . . 0.0 110.991 . . . . . . . . . 0 0 . 1 . 010 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -154.72 118.3 0.85 Allowed Glycine 0 C--N 1.342 0.907 0 N-CA-C 112.03 -0.428 . . . . 0.0 112.03 178.087 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 42.3 m-70 -131.61 -169.48 2.2 Favored 'General case' 0 N--CA 1.482 1.148 0 C-N-CA 124.778 1.231 . . . . 0.0 108.414 171.01 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 34.4 t-80 58.12 69.91 0.69 Allowed 'General case' 0 CA--C 1.549 0.932 0 C-N-CA 124.069 0.948 . . . . 0.0 109.671 -174.446 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 42.0 m80 -53.89 144.14 19.51 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 123.306 0.642 . . . . 0.0 111.348 -177.153 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 24.1 m170 -68.46 125.91 27.96 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 123.373 0.669 . . . . 0.0 110.898 -173.489 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 33.1 t60 72.04 22.11 3.83 Favored 'General case' 0 N--CA 1.489 1.478 0 C-N-CA 125.333 1.453 . . . . 0.0 111.345 -179.454 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 57.3 t-80 -70.95 99.88 1.86 Allowed 'General case' 0 C--N 1.357 0.934 0 N-CA-C 109.588 -0.523 . . . . 0.0 109.588 175.045 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 16.9 m -94.44 147.05 23.63 Favored 'General case' 0 CA--C 1.546 0.799 0 CA-C-N 115.229 -0.896 . . . . 0.0 110.691 -175.557 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 29.8 m80 -111.7 20.6 16.94 Favored 'General case' 0 N--CA 1.486 1.331 0 C-N-CA 123.779 0.831 . . . . 0.0 109.916 170.83 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.4 mmt 61.21 21.37 11.83 Favored 'General case' 0 N--CA 1.485 1.325 0 C-N-CA 124.453 1.101 . . . . 0.0 110.763 -171.173 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -96.82 99.92 11.48 Favored 'General case' 0 C--N 1.346 0.425 0 C-N-CA 124.548 1.139 . . . . 0.0 108.2 178.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 25.5 t70 -108.16 99.81 33.53 Favored Pre-proline 0 C--O 1.241 0.621 0 C-N-CA 122.698 0.399 . . . . 0.0 110.397 -173.236 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 51.7 Cg_endo -88.86 59.6 2.47 Favored 'Trans proline' 0 C--N 1.371 1.755 0 C-N-CA 122.921 2.414 . . . . 0.0 109.074 168.232 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -45.97 -83.56 0.02 OUTLIER Glycine 0 C--N 1.355 1.638 0 N-CA-C 115.809 1.084 . . . . 0.0 115.809 -168.094 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 72.6 ttt-85 -56.91 -49.79 74.52 Favored 'General case' 0 CA--C 1.546 0.8 0 C-N-CA 124.473 1.109 . . . . 0.0 112.598 -173.776 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.4 tt0 -61.76 -48.71 79.46 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 123.483 0.713 . . . . 0.0 111.905 -177.412 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -67.29 -29.41 74.26 Favored Glycine 0 C--N 1.345 1.058 0 O-C-N 123.971 0.794 . . . . 0.0 114.709 179.395 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 29.4 m170 -75.99 -38.68 57.12 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.186 0.594 . . . . 0.0 109.78 177.049 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.599 HD12 HG21 ' A' ' 54' ' ' VAL . 2.7 tm? -64.54 -43.64 93.34 Favored 'General case' 0 CA--C 1.544 0.719 0 CA-C-N 114.367 -1.288 . . . . 0.0 109.712 176.529 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 39.3 tt0 -65.55 -40.39 92.79 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 124.272 1.029 . . . . 0.0 110.043 176.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 28.8 tt0 -62.0 -38.09 87.3 Favored 'General case' 0 N--CA 1.477 0.913 0 C-N-CA 123.738 0.815 . . . . 0.0 110.223 177.289 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.483 ' O ' HG23 ' A' ' 27' ' ' VAL . 22.8 mmm180 -63.76 -50.83 67.5 Favored 'General case' 0 C--N 1.357 0.911 0 C-N-CA 122.737 0.415 . . . . 0.0 110.919 174.865 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.43 HG21 HD21 ' A' ' 55' ' ' LEU . 87.8 mt -56.1 -54.23 29.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.086 0 O-C-N 123.863 0.727 . . . . 0.0 110.354 -175.641 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.537 HD21 ' HB3' ' A' ' 63' ' ' LYS . 90.0 mt -65.01 -35.43 81.17 Favored 'General case' 0 CA--C 1.544 0.72 0 C-N-CA 123.953 0.901 . . . . 0.0 111.486 -176.305 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 57.5 tp60 -66.09 -47.4 74.33 Favored 'General case' 0 N--CA 1.48 1.043 0 C-N-CA 123.296 0.638 . . . . 0.0 110.328 179.067 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.483 HG23 ' O ' ' A' ' 23' ' ' ARG . 61.1 t -59.81 -40.9 83.89 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.092 0 C-N-CA 124.516 1.126 . . . . 0.0 111.205 179.2 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 81.5 mt -66.57 -38.65 87.52 Favored 'General case' 0 CA--C 1.548 0.885 0 CA-C-N 115.223 -0.899 . . . . 0.0 110.742 178.272 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 73.5 m -68.73 -50.46 50.53 Favored 'General case' 0 CA--C 1.546 0.797 0 C-N-CA 124.121 0.968 . . . . 0.0 111.776 -179.636 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 18.9 mm-40 -67.44 -40.46 85.44 Favored 'General case' 0 N--CA 1.48 1.054 0 C-N-CA 122.97 0.508 . . . . 0.0 110.994 -173.813 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -61.91 -42.19 98.8 Favored 'General case' 0 C--O 1.241 0.62 0 CA-C-N 115.189 -0.914 . . . . 0.0 110.386 173.632 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.76 29.4 64.4 Favored Glycine 0 C--N 1.353 1.486 0 CA-C-N 115.164 -0.926 . . . . 0.0 112.249 -174.779 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 70.2 m -150.94 153.89 33.71 Favored Pre-proline 0 C--O 1.242 0.665 0 C-N-CA 125.296 1.438 . . . . 0.0 107.897 -174.171 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 28.1 Cg_endo -60.98 114.05 2.0 Allowed 'Trans proline' 0 C--N 1.374 1.882 0 C-N-CA 122.194 1.929 . . . . 0.0 111.382 176.328 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 98.7 t -96.23 128.21 47.64 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.687 0 C-N-CA 124.357 1.063 . . . . 0.0 108.281 -176.284 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.553 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 49.0 mtmt -58.58 154.72 13.68 Favored 'General case' 0 N--CA 1.475 0.775 0 C-N-CA 123.447 0.699 . . . . 0.0 111.397 179.409 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . . . . . . . . . 23.5 tp -67.43 -50.74 58.02 Favored 'General case' 0 CA--C 1.545 0.761 0 CA-C-N 114.967 -1.015 . . . . 0.0 110.017 177.456 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -53.67 -28.1 31.42 Favored 'General case' 0 N--CA 1.485 1.278 0 N-CA-C 113.339 0.866 . . . . 0.0 113.339 168.548 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 52.4 tt0 -81.88 -30.64 31.87 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 122.909 0.484 . . . . 0.0 109.882 177.121 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 85.9 mt -66.36 -26.38 67.24 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 123.138 0.575 . . . . 0.0 110.087 175.005 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.448 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.5 t -58.52 -53.23 49.64 Favored 'Isoleucine or valine' 0 N--CA 1.487 1.407 0 C-N-CA 123.498 0.719 . . . . 0.0 111.4 174.63 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 20.9 ptmt -70.79 -40.72 72.38 Favored 'General case' 0 N--CA 1.477 0.916 0 N-CA-C 112.028 0.381 . . . . 0.0 112.028 -177.887 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 11.1 mm-40 -69.46 -51.77 32.96 Favored 'General case' 0 CA--C 1.544 0.747 0 C-N-CA 122.972 0.509 . . . . 0.0 112.128 -177.451 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 57.2 m -78.03 -13.22 59.95 Favored 'General case' 0 N--CA 1.481 1.108 0 C-N-CA 122.385 0.274 . . . . 0.0 110.789 -179.465 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.1 mm-40 60.38 31.39 20.36 Favored 'General case' 0 N--CA 1.482 1.139 0 C-N-CA 125.008 1.323 . . . . 0.0 111.891 178.816 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -120.24 154.43 56.13 Favored Pre-proline 0 N--CA 1.473 0.681 0 CA-C-N 115.338 -0.846 . . . . 0.0 110.501 -178.414 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.444 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 11.4 Cg_endo -56.12 136.72 76.56 Favored 'Trans proline' 0 C--N 1.377 2.051 0 C-N-CA 122.81 2.34 . . . . 0.0 111.632 169.999 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.414 ' HA ' HD12 ' A' ' 51' ' ' LEU . 26.0 ttpp -48.96 -41.5 34.32 Favored 'General case' 0 N--CA 1.479 1.018 0 C-N-CA 124.196 0.998 . . . . 0.0 112.225 172.858 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.444 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 21.8 ptt180 -59.0 -37.62 77.29 Favored 'General case' 0 N--CA 1.484 1.229 0 C-N-CA 122.826 0.45 . . . . 0.0 111.924 179.289 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.41 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 23.8 tp10 -66.79 -50.15 63.58 Favored 'General case' 0 C--O 1.243 0.732 0 C-N-CA 123.727 0.811 . . . . 0.0 110.029 175.727 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.464 HD23 HD11 ' A' ' 20' ' ' LEU . 76.7 mt -57.22 -50.08 74.0 Favored 'General case' 0 N--CA 1.475 0.789 0 CA-C-N 114.569 -1.196 . . . . 0.0 112.157 -176.238 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 3.3 m-20 -52.07 -51.54 56.97 Favored 'General case' 0 N--CA 1.489 1.503 0 O-C-N 124.465 1.103 . . . . 0.0 111.504 -176.938 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 25.6 mm-40 -66.86 -37.06 83.73 Favored 'General case' 0 CA--C 1.545 0.755 0 O-C-N 124.127 0.892 . . . . 0.0 111.524 -174.59 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.704 HG12 ' SD ' ' A' ' 58' ' ' MET . 95.7 t -66.38 -47.52 83.76 Favored 'Isoleucine or valine' 0 C--N 1.357 0.915 0 N-CA-C 109.547 -0.538 . . . . 0.0 109.547 174.491 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.43 HD21 HG21 ' A' ' 24' ' ' ILE . 39.3 mt -57.72 -37.77 74.1 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 125.223 1.409 . . . . 0.0 112.888 177.997 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 21.2 m-85 -68.54 -28.64 67.16 Favored 'General case' 0 C--N 1.354 0.768 0 C-N-CA 122.903 0.481 . . . . 0.0 111.413 178.586 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 36.4 ttm-85 -71.54 -53.55 13.44 Favored 'General case' 0 CA--C 1.55 0.98 0 N-CA-C 109.218 -0.66 . . . . 0.0 109.218 171.358 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.704 ' SD ' HG12 ' A' ' 54' ' ' VAL . 77.9 mtp -61.01 -32.38 71.98 Favored 'General case' 0 N--CA 1.481 1.099 0 C-N-CA 124.971 1.308 . . . . 0.0 113.051 -172.83 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 15.2 ptmm? -70.44 -34.16 72.14 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.366 0.266 . . . . 0.0 111.162 178.71 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 58.3 mtpt -71.54 -24.56 61.97 Favored 'General case' 0 N--CA 1.479 0.997 0 C-N-CA 123.377 0.671 . . . . 0.0 110.326 173.085 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 44.1 mt-10 -89.07 5.8 42.79 Favored 'General case' 0 CA--C 1.556 1.194 0 C-N-CA 124.368 1.067 . . . . 0.0 110.718 174.261 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.4 mm? 60.7 14.93 5.39 Favored 'General case' 0 N--CA 1.5 2.031 0 C-N-CA 125.341 1.456 . . . . 0.0 112.775 177.384 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.537 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.3 mttt -73.97 -40.9 62.68 Favored 'General case' 0 C--O 1.245 0.825 0 C-N-CA 124.214 1.006 . . . . 0.0 110.838 178.106 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 33.1 m -126.45 158.35 36.55 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.908 0 C-N-CA 123.492 0.717 . . . . 0.0 110.517 179.109 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 43.1 m -135.63 150.27 49.58 Favored 'General case' 0 CA--C 1.538 0.516 0 C-N-CA 124.627 1.171 . . . . 0.0 108.323 173.738 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.1 tp -99.96 110.77 23.09 Favored 'General case' 0 CA--C 1.544 0.729 0 N-CA-C 107.782 -1.192 . . . . 0.0 107.782 -179.056 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.5 p -82.54 -46.39 13.44 Favored 'General case' 0 N--CA 1.478 0.936 0 C-N-CA 123.672 0.789 . . . . 0.0 111.596 -177.43 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.424 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 68.4 m -133.21 163.65 49.59 Favored Pre-proline 0 CA--C 1.556 1.19 0 CA-C-O 117.311 -1.328 . . . . 0.0 108.18 -178.585 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.402 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 19.3 Cg_exo -25.52 -63.0 0.06 OUTLIER 'Trans proline' 0 C--N 1.393 2.901 1 C-N-CA 125.464 4.109 . . . . 0.0 116.432 -174.913 . . . . . . . . 3 3 . 1 . 010 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -127.58 53.59 1.74 Allowed 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.613 0.765 . . . . 0.0 110.508 172.904 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.553 ' HA ' ' HA ' ' A' ' 36' ' ' LYS . 36.0 m -132.39 120.53 22.15 Favored 'General case' 0 CA--C 1.538 0.503 0 N-CA-C 107.708 -1.219 . . . . 0.0 107.708 172.379 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 88.0 m95 -106.21 169.17 8.66 Favored 'General case' 0 N--CA 1.476 0.836 0 C-N-CA 124.449 1.1 . . . . 0.0 109.273 -174.666 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 41.2 t -151.16 159.96 44.14 Favored 'General case' 0 N--CA 1.473 0.686 0 C-N-CA 123.656 0.782 . . . . 0.0 109.633 -175.726 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.642 HD21 ' HB2' ' A' ' 78' ' ' ASP . 35.7 tp -72.89 104.3 4.0 Favored 'General case' 0 CA--C 1.542 0.669 0 N-CA-C 107.874 -1.158 . . . . 0.0 107.874 174.634 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -75.41 -25.84 67.19 Favored Glycine 0 C--N 1.34 0.751 0 CA-C-N 115.43 -0.805 . . . . 0.0 111.64 177.623 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -76.12 161.79 52.21 Favored Glycine 0 C--N 1.349 1.27 0 O-C-N 123.94 0.435 . . . . 0.0 112.911 176.133 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 10.8 t -95.68 34.15 1.54 Allowed 'General case' 0 CA--C 1.556 1.181 0 C-N-CA 123.594 0.758 . . . . 0.0 109.803 178.015 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . 0.642 ' HB2' HD21 ' A' ' 74' ' ' LEU . 11.7 m-20 -63.28 119.92 57.28 Favored Pre-proline 0 N--CA 1.476 0.87 0 C-N-CA 123.88 0.872 . . . . 0.0 111.939 -174.511 . . . . . . . . 2 2 . 1 . 010 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 90.5 Cg_endo -83.47 -162.95 0.18 Allowed 'Trans proline' 0 C--N 1.378 2.095 0 C-N-CA 123.367 2.711 . . . . 0.0 111.629 174.649 . . . . . . . . 1 1 . 1 . 010 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.4 pt-20 . . . . . 0 CA--C 1.555 1.16 0 C-N-CA 123.573 0.749 . . . . 0.0 109.626 175.143 . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 1.4 mpt? . . . . . 0 N--CA 1.478 0.928 0 N-CA-C 109.45 -0.574 . . . . 0.0 109.45 . . . . . . . . . 0 0 . 1 . 011 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 165.16 160.3 12.39 Favored Glycine 0 C--N 1.338 0.694 0 N-CA-C 111.002 -0.839 . . . . 0.0 111.002 -178.611 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 84.6 t60 59.21 88.93 0.06 Allowed 'General case' 0 CA--C 1.55 0.956 0 C-N-CA 124.715 1.206 . . . . 0.0 110.342 -174.431 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 79.3 m-70 -104.77 165.5 11.02 Favored 'General case' 0 N--CA 1.475 0.778 0 C-N-CA 123.392 0.677 . . . . 0.0 109.47 -177.696 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.7 p80 -125.32 39.45 3.97 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.302 0.641 . . . . 0.0 110.67 -177.927 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 28.1 p80 -63.25 -18.41 63.52 Favored 'General case' 0 N--CA 1.494 1.738 0 C-N-CA 122.702 0.401 . . . . 0.0 111.976 -178.005 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 5.2 p80 -62.42 139.58 58.56 Favored 'General case' 0 CA--C 1.543 0.687 0 C-N-CA 123.452 0.701 . . . . 0.0 110.341 169.387 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.8 m-70 -71.76 -39.96 69.65 Favored 'General case' 0 N--CA 1.478 0.939 0 C-N-CA 124.189 0.996 . . . . 0.0 111.604 -174.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 53.7 p -77.73 138.89 39.28 Favored 'General case' 0 N--CA 1.472 0.637 0 N-CA-C 109.617 -0.512 . . . . 0.0 109.617 176.446 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 12.8 t60 -73.47 89.1 1.64 Allowed 'General case' 0 CA--C 1.541 0.632 0 N-CA-C 109.297 -0.631 . . . . 0.0 109.297 -178.885 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . 0.498 ' SD ' ' N ' ' A' ' 12' ' ' ALA . 1.2 tmt? -76.09 159.6 30.59 Favored 'General case' 0 N--CA 1.478 0.966 0 N-CA-C 107.539 -1.282 . . . . 0.0 107.539 169.045 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . 0.498 ' N ' ' SD ' ' A' ' 11' ' ' MET . . . 68.6 177.44 0.26 Allowed 'General case' 0 C--O 1.249 1.029 0 C-N-CA 123.961 0.904 . . . . 0.0 110.285 -174.374 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 13.7 m-20 51.78 69.67 2.36 Favored Pre-proline 0 N--CA 1.477 0.922 0 C-N-CA 123.601 0.76 . . . . 0.0 109.278 -166.432 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 90.0 Cg_endo -71.86 -172.71 0.87 Allowed 'Trans proline' 0 C--N 1.37 1.674 0 C-N-CA 122.533 2.155 . . . . 0.0 112.59 -169.716 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -79.29 -179.5 52.11 Favored Glycine 0 C--O 1.252 1.252 0 N-CA-C 110.15 -1.18 . . . . 0.0 110.15 168.171 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.436 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 38.5 ptt180 -58.61 -38.39 77.9 Favored 'General case' 0 CA--C 1.542 0.658 0 CA-C-N 116.925 0.362 . . . . 0.0 111.842 -179.167 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.6 tt0 -64.4 -50.73 66.47 Favored 'General case' 0 C--N 1.358 0.974 0 C-N-CA 123.751 0.821 . . . . 0.0 110.237 179.666 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -54.42 -41.0 70.89 Favored Glycine 0 C--N 1.351 1.403 0 O-C-N 123.81 0.694 . . . . 0.0 114.37 178.414 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 72.3 t60 -75.76 -40.02 56.07 Favored 'General case' 0 N--CA 1.478 0.955 0 C-N-CA 122.445 0.298 . . . . 0.0 110.807 179.669 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.484 HD11 HD23 ' A' ' 51' ' ' LEU . 1.5 tm? -60.0 -52.8 63.86 Favored 'General case' 0 N--CA 1.479 1.005 0 C-N-CA 124.817 1.247 . . . . 0.0 110.098 -178.911 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.759 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.8 tt0 -62.19 -44.66 96.1 Favored 'General case' 0 N--CA 1.469 0.506 0 C-N-CA 124.995 1.318 . . . . 0.0 110.513 178.606 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 55.3 tt0 -56.91 -44.98 82.93 Favored 'General case' 0 C--N 1.356 0.852 0 CA-C-N 115.354 -0.839 . . . . 0.0 110.37 179.264 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.438 ' NE ' ' HA ' ' A' ' 23' ' ' ARG . 0.8 OUTLIER -66.27 -47.7 72.82 Favored 'General case' 0 C--N 1.348 0.512 0 C-N-CA 123.312 0.645 . . . . 0.0 112.33 -178.793 . . . . . . . . 3 3 . 1 . 011 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 54.8 mt -60.74 -50.99 78.22 Favored 'Isoleucine or valine' 0 CA--C 1.542 0.64 0 O-C-N 123.589 0.556 . . . . 0.0 110.126 -178.138 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 91.4 mt -64.2 -38.36 90.77 Favored 'General case' 0 N--CA 1.473 0.702 0 C-N-CA 123.122 0.569 . . . . 0.0 111.806 -177.59 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 59.3 tt0 -71.47 -40.12 70.49 Favored 'General case' 0 N--CA 1.473 0.715 0 O-C-N 123.747 0.654 . . . . 0.0 110.456 -176.609 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 54.4 t -61.89 -39.16 82.55 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.281 0 C-N-CA 123.144 0.578 . . . . 0.0 110.032 174.148 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 92.8 mt -72.42 -29.03 63.34 Favored 'General case' 0 N--CA 1.472 0.626 0 CA-C-N 115.607 -0.724 . . . . 0.0 111.564 -179.688 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . 0.481 ' HA ' HD22 ' A' ' 74' ' ' LEU . 86.4 m -75.49 -44.15 45.42 Favored 'General case' 0 C--N 1.353 0.755 0 C-N-CA 123.584 0.754 . . . . 0.0 111.395 176.79 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 40.0 mt-10 -70.11 -37.25 75.3 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.498 0.719 . . . . 0.0 110.229 -178.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.33 -39.82 71.12 Favored 'General case' 0 N--CA 1.472 0.643 0 C-N-CA 122.959 0.504 . . . . 0.0 109.7 172.711 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 58.53 31.5 67.01 Favored Glycine 0 C--N 1.351 1.38 0 CA-C-N 115.366 -0.834 . . . . 0.0 112.751 -175.633 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 38.4 t -160.45 149.47 13.77 Favored Pre-proline 0 CA--C 1.544 0.722 0 C-N-CA 123.946 0.899 . . . . 0.0 109.091 -166.671 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 27.1 Cg_endo -60.77 113.4 1.69 Allowed 'Trans proline' 0 C--N 1.376 1.998 0 C-N-CA 122.976 2.451 . . . . 0.0 112.712 177.377 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 97.3 t -102.61 138.61 26.25 Favored 'Isoleucine or valine' 0 CA--C 1.538 0.498 0 C-N-CA 124.662 1.185 . . . . 0.0 108.208 179.121 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 98.2 mttt -66.87 149.48 50.53 Favored 'General case' 0 N--CA 1.473 0.69 0 C-N-CA 123.347 0.659 . . . . 0.0 110.588 179.724 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.466 ' O ' HG23 ' A' ' 41' ' ' VAL . 25.3 tp -59.37 -49.08 79.19 Favored 'General case' 0 N--CA 1.473 0.696 0 O-C-N 124.555 1.159 . . . . 0.0 110.953 178.573 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.75 -36.98 17.63 Favored 'General case' 0 N--CA 1.48 1.03 0 C-N-CA 124.107 0.963 . . . . 0.0 113.117 171.461 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.524 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 51.2 tt0 -76.66 -34.48 58.25 Favored 'General case' 0 C--N 1.352 0.702 0 N-CA-C 109.741 -0.466 . . . . 0.0 109.741 178.766 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 96.0 mt -65.45 -29.24 69.89 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.288 0.635 . . . . 0.0 110.497 177.417 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.495 ' HA ' HD11 ' A' ' 51' ' ' LEU . 93.9 t -59.8 -53.09 53.24 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.925 0 C-N-CA 123.839 0.855 . . . . 0.0 111.155 176.477 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.459 ' HE2' ' HG3' ' A' ' 39' ' ' GLN . 63.5 pttt -73.41 -34.73 65.64 Favored 'General case' 0 CA--C 1.544 0.728 0 O-C-N 123.648 0.592 . . . . 0.0 111.487 -177.767 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.524 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 26.9 mm-40 -62.04 -55.86 24.89 Favored 'General case' 0 N--CA 1.482 1.131 0 C-N-CA 122.63 0.372 . . . . 0.0 110.616 177.153 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 45.4 t -81.83 -10.82 59.21 Favored 'General case' 0 CA--C 1.542 0.669 0 C-N-CA 122.674 0.39 . . . . 0.0 110.714 -174.309 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 78.0 mt-30 56.32 32.62 20.8 Favored 'General case' 0 N--CA 1.487 1.4 0 C-N-CA 124.787 1.235 . . . . 0.0 110.886 -178.572 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -121.61 149.72 53.48 Favored Pre-proline 0 CA--C 1.544 0.716 0 CA-C-N 114.993 -1.003 . . . . 0.0 110.176 -173.896 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 20.4 Cg_endo -61.11 130.93 34.37 Favored 'Trans proline' 0 C--N 1.373 1.836 0 C-N-CA 122.599 2.199 . . . . 0.0 111.609 178.507 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.4 ttmt -44.53 -36.29 2.91 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 125.387 1.475 . . . . 0.0 112.924 172.618 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 40.9 ttm180 -56.33 -51.75 67.09 Favored 'General case' 0 CA--C 1.554 1.126 0 C-N-CA 124.264 1.025 . . . . 0.0 111.544 175.57 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 41.3 tt0 -70.08 -39.52 75.56 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.229 0.612 . . . . 0.0 111.061 -178.039 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.495 HD11 ' HA ' ' A' ' 41' ' ' VAL . 93.9 mt -56.66 -52.46 64.82 Favored 'General case' 0 C--N 1.359 1.005 0 O-C-N 123.938 0.774 . . . . 0.0 110.67 175.358 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 59.8 m-20 -50.54 -51.39 48.27 Favored 'General case' 0 N--CA 1.486 1.325 0 C-N-CA 125.137 1.375 . . . . 0.0 111.886 178.504 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -50.89 -52.83 37.94 Favored 'General case' 0 N--CA 1.475 0.795 0 C-N-CA 124.336 1.054 . . . . 0.0 112.032 178.686 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 94.7 t -72.39 -37.86 59.14 Favored 'Isoleucine or valine' 0 CA--C 1.546 0.825 0 CA-C-N 115.7 -0.682 . . . . 0.0 110.471 -176.916 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.414 HD13 ' NE1' ' A' ' 72' ' ' TRP . 38.8 mt -57.39 -46.02 83.88 Favored 'General case' 0 N--CA 1.48 1.052 0 C-N-CA 124.863 1.265 . . . . 0.0 114.115 177.633 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 14.1 m-85 -71.08 -28.76 64.57 Favored 'General case' 0 N--CA 1.484 1.251 0 CA-C-N 119.271 0.941 . . . . 0.0 110.908 -178.821 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.43 ' O ' ' HG3' ' A' ' 61' ' ' GLU . 10.5 tpp85 -66.73 -50.21 63.51 Favored 'General case' 0 CA--C 1.539 0.555 0 N-CA-C 108.684 -0.858 . . . . 0.0 108.684 174.164 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.759 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 76.0 mtm -66.68 -27.53 67.73 Favored 'General case' 0 C--N 1.357 0.896 0 C-N-CA 124.109 0.963 . . . . 0.0 112.138 179.668 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.2 tttm -67.11 -40.37 86.87 Favored 'General case' 0 N--CA 1.471 0.59 0 C-N-CA 123.583 0.753 . . . . 0.0 109.891 177.733 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.1 ttpt -71.44 -34.54 70.37 Favored 'General case' 0 N--CA 1.475 0.804 0 O-C-N 123.873 0.733 . . . . 0.0 110.747 173.263 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.43 ' HG3' ' O ' ' A' ' 57' ' ' ARG . 51.0 mt-10 -76.69 -5.17 46.87 Favored 'General case' 0 N--CA 1.48 1.055 0 C-N-CA 123.154 0.582 . . . . 0.0 111.197 174.966 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 76.8 mt 66.04 14.03 9.4 Favored 'General case' 0 N--CA 1.491 1.621 0 C-N-CA 125.783 1.633 . . . . 0.0 112.492 177.194 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.541 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 93.2 mttt -69.65 -35.31 75.06 Favored 'General case' 0 C--N 1.35 0.623 0 C-N-CA 124.374 1.07 . . . . 0.0 110.611 175.218 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.2 m -126.69 152.58 34.6 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.035 0 O-C-N 123.907 0.754 . . . . 0.0 109.479 176.383 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 45.1 t -119.86 147.39 44.75 Favored 'General case' 0 N--CA 1.467 0.417 0 C-N-CA 124.14 0.976 . . . . 0.0 108.826 176.093 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 34.6 tp -99.38 101.67 13.02 Favored 'General case' 0 N--CA 1.472 0.634 0 N-CA-C 108.231 -1.025 . . . . 0.0 108.231 177.19 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 23.1 p -87.69 -34.15 18.51 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 123.677 0.791 . . . . 0.0 111.456 -175.097 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.436 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 45.7 m -139.42 161.16 58.62 Favored Pre-proline 0 N--CA 1.482 1.142 0 CA-C-O 117.21 -1.376 . . . . 0.0 107.57 176.301 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 25.1 Cg_exo -25.53 -59.63 0.07 OUTLIER 'Trans proline' 0 C--N 1.401 3.323 0 C-N-CA 125.261 3.974 . . . . 0.0 116.606 -176.175 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -128.83 53.4 1.86 Allowed 'General case' 0 CA--C 1.546 0.824 0 CA-C-O 121.456 0.646 . . . . 0.0 110.586 173.141 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.436 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 70.1 m -130.97 127.88 39.29 Favored 'General case' 0 N--CA 1.475 0.797 0 N-CA-C 109.13 -0.693 . . . . 0.0 109.13 175.758 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.414 ' NE1' HD13 ' A' ' 55' ' ' LEU . 81.6 m95 -118.38 137.55 53.04 Favored 'General case' 0 N--CA 1.471 0.603 0 C-N-CA 123.421 0.688 . . . . 0.0 110.468 -171.487 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 49.9 t -116.19 164.3 14.69 Favored 'General case' 0 N--CA 1.468 0.463 0 C-N-CA 123.949 0.899 . . . . 0.0 109.518 176.088 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.481 HD22 ' HA ' ' A' ' 29' ' ' THR . 40.9 tp -67.64 108.56 2.94 Favored 'General case' 0 CA--C 1.543 0.71 0 N-CA-C 108.868 -0.79 . . . . 0.0 108.868 173.962 . . . . . . . . 2 2 . 1 . 011 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -66.04 -25.47 72.11 Favored Glycine 0 C--N 1.346 1.121 0 O-C-N 123.782 0.676 . . . . 0.0 112.533 176.713 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -83.35 57.37 5.06 Favored Glycine 0 C--N 1.356 1.674 0 N-CA-C 111.891 -0.483 . . . . 0.0 111.891 172.596 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 15.1 t -89.78 -155.73 0.38 Allowed 'General case' 0 CA--C 1.552 1.052 0 C-N-CA 125.294 1.438 . . . . 0.0 109.75 -175.32 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 18.0 m-20 -53.81 133.77 56.69 Favored Pre-proline 0 N--CA 1.486 1.363 0 C-N-CA 123.939 0.895 . . . . 0.0 110.78 175.869 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_endo -54.02 138.1 69.97 Favored 'Trans proline' 0 C--N 1.387 2.563 0 C-N-CA 123.325 2.683 . . . . 0.0 112.457 -177.968 . . . . . . . . 1 1 . 1 . 011 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 44.3 mt-10 . . . . . 0 N--CA 1.479 1.016 0 C-N-CA 125.125 1.37 . . . . 0.0 110.668 -174.214 . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 63.3 mtt . . . . . 0 N--CA 1.486 1.352 0 N-CA-C 109.481 -0.563 . . . . 0.0 109.481 . . . . . . . . . 0 0 . 1 . 012 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -83.11 -12.75 78.73 Favored Glycine 0 CA--C 1.534 1.223 0 CA-C-N 116.02 -0.536 . . . . 0.0 113.273 177.635 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 30.0 t60 65.24 9.55 5.71 Favored 'General case' 0 N--CA 1.494 1.734 0 C-N-CA 124.431 1.093 . . . . 0.0 112.688 175.715 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 91.7 m-70 66.79 -71.39 0.1 Allowed 'General case' 0 N--CA 1.484 1.257 0 C-N-CA 124.949 1.3 . . . . 0.0 109.542 -167.998 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 25.1 m-70 -84.79 130.78 34.63 Favored 'General case' 0 N--CA 1.472 0.638 0 C-N-CA 123.847 0.859 . . . . 0.0 109.045 174.733 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 13.1 m-70 -82.54 -14.12 55.46 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.073 0.549 . . . . 0.0 112.034 -174.729 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 54.5 m-70 -96.07 114.14 25.81 Favored 'General case' 0 N--CA 1.477 0.9 0 N-CA-C 108.901 -0.777 . . . . 0.0 108.901 175.109 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 76.0 t60 -64.93 -29.08 70.0 Favored 'General case' 0 N--CA 1.485 1.298 0 C-N-CA 123.875 0.87 . . . . 0.0 110.883 177.483 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 32.6 p -56.8 118.78 5.25 Favored 'General case' 0 CA--C 1.542 0.635 0 C-N-CA 124.219 1.008 . . . . 0.0 110.817 178.997 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 53.7 t-80 -68.54 -17.53 64.17 Favored 'General case' 0 CA--C 1.552 1.023 0 C-N-CA 123.952 0.901 . . . . 0.0 111.516 -179.36 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 12.6 tpt 67.62 90.38 0.1 Allowed 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 124.743 1.217 . . . . 0.0 108.921 -171.897 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 65.55 104.11 0.04 OUTLIER 'General case' 0 CA--C 1.54 0.571 0 C-N-CA 124.765 1.226 . . . . 0.0 111.156 -177.181 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 2.9 p-10 -146.95 97.98 4.13 Favored Pre-proline 0 CA--C 1.545 0.758 0 C-N-CA 123.608 0.763 . . . . 0.0 110.754 -176.654 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 1.4 Cg_endo -88.99 12.69 2.67 Favored 'Trans proline' 0 CA--C 1.563 1.939 0 C-N-CA 123.258 2.638 . . . . 0.0 111.257 159.135 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 66.37 -84.05 0.1 Allowed Glycine 0 C--N 1.347 1.153 0 CA-C-N 114.131 -1.395 . . . . 0.0 112.5 -178.42 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 17.0 mtp180 -57.32 -50.52 72.68 Favored 'General case' 0 C--O 1.21 -1.017 0 C-N-CA 123.345 0.658 . . . . 0.0 110.917 179.947 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 2.3 mp0 -65.22 -37.88 88.67 Favored 'General case' 0 N--CA 1.479 0.997 0 O-C-N 124.016 0.822 . . . . 0.0 110.693 -173.17 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -63.15 -48.84 76.39 Favored Glycine 0 C--N 1.353 1.523 0 O-C-N 123.527 0.517 . . . . 0.0 114.275 174.904 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 80.2 m-70 -64.98 -40.5 95.07 Favored 'General case' 0 N--CA 1.494 1.76 0 CA-C-O 121.309 0.576 . . . . 0.0 110.028 179.734 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.417 HD12 HG21 ' A' ' 54' ' ' VAL . 2.9 tm? -62.0 -42.72 99.46 Favored 'General case' 0 N--CA 1.473 0.679 0 C-N-CA 125.436 1.495 . . . . 0.0 110.215 177.89 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.3 tt0 -64.05 -40.0 95.32 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 124.334 1.054 . . . . 0.0 110.398 177.64 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 99.2 mt-30 -63.71 -43.16 97.41 Favored 'General case' 0 N--CA 1.478 0.959 0 CA-C-N 115.582 -0.735 . . . . 0.0 110.532 177.91 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.433 ' O ' HG23 ' A' ' 27' ' ' VAL . 42.8 mmm-85 -66.26 -45.4 80.69 Favored 'General case' 0 C--N 1.353 0.745 0 C-N-CA 123.564 0.746 . . . . 0.0 111.394 -177.458 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.522 HG21 HD21 ' A' ' 55' ' ' LEU . 75.5 mt -57.07 -45.41 84.08 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.833 0 O-C-N 123.952 0.782 . . . . 0.0 109.689 178.878 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.638 HD21 ' HB3' ' A' ' 63' ' ' LYS . 66.5 mt -65.0 -38.06 89.71 Favored 'General case' 0 N--CA 1.473 0.676 0 O-C-N 123.607 0.567 . . . . 0.0 111.169 -179.265 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.541 HE21 ' HG3' ' A' ' 30' ' ' GLU . 22.7 tp60 -69.42 -44.24 71.74 Favored 'General case' 0 CA--C 1.547 0.832 0 O-C-N 123.895 0.747 . . . . 0.0 109.983 -174.838 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.433 HG23 ' O ' ' A' ' 23' ' ' ARG . 98.5 t -58.85 -46.13 91.24 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.007 0 C-N-CA 124.306 1.043 . . . . 0.0 110.793 175.438 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 98.1 mt -66.39 -34.11 77.23 Favored 'General case' 0 N--CA 1.477 0.901 0 CA-C-N 115.288 -0.869 . . . . 0.0 111.328 -178.21 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -76.56 -45.28 31.22 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 122.815 0.446 . . . . 0.0 110.714 -177.44 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.541 ' HG3' HE21 ' A' ' 26' ' ' GLN . 46.0 mt-10 -68.53 -42.12 78.91 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 122.923 0.489 . . . . 0.0 110.628 -175.948 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -56.18 -42.06 76.49 Favored 'General case' 0 N--CA 1.479 0.998 0 O-C-N 124.236 0.96 . . . . 0.0 111.758 177.792 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.75 28.06 71.03 Favored Glycine 0 C--N 1.35 1.346 0 O-C-N 123.61 0.568 . . . . 0.0 112.311 -176.03 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.7 p -161.38 154.56 17.8 Favored Pre-proline 0 CA--C 1.547 0.844 0 C-N-CA 124.541 1.137 . . . . 0.0 108.693 -172.88 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.457 ' HB3' HG21 ' A' ' 67' ' ' THR . 29.4 Cg_endo -60.86 124.35 14.78 Favored 'Trans proline' 0 C--N 1.374 1.916 0 C-N-CA 122.721 2.281 . . . . 0.0 112.426 178.011 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 72.8 t -105.41 128.06 59.7 Favored 'Isoleucine or valine' 0 N--CA 1.469 0.525 0 N-CA-C 108.102 -1.073 . . . . 0.0 108.102 179.65 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.484 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 97.9 mttt -68.29 150.6 48.05 Favored 'General case' 0 N--CA 1.472 0.654 0 N-CA-C 109.815 -0.439 . . . . 0.0 109.815 177.246 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.431 ' O ' HG23 ' A' ' 41' ' ' VAL . 40.2 tp -56.94 -40.11 75.78 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.44 0.696 . . . . 0.0 110.071 174.434 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.09 -52.83 6.89 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.879 1.272 . . . . 0.0 112.227 167.001 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.457 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 10.2 tt0 -75.39 -25.32 57.53 Favored 'General case' 0 C--O 1.207 -1.167 0 CA-C-O 119.302 -0.38 . . . . 0.0 110.573 -178.15 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 94.2 mt -65.25 -35.16 80.17 Favored 'General case' 0 N--CA 1.489 1.501 0 CA-C-N 118.73 0.696 . . . . 0.0 110.525 174.223 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.431 HG23 ' O ' ' A' ' 37' ' ' LEU . 59.9 t -60.0 -43.03 91.63 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.564 0 C-N-CA 123.499 0.72 . . . . 0.0 110.082 172.399 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 56.3 tttm -66.82 -57.46 6.99 Favored 'General case' 0 CA--C 1.552 1.03 0 C-N-CA 124.387 1.075 . . . . 0.0 111.017 -178.569 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.457 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -65.37 -53.57 41.5 Favored 'General case' 0 N--CA 1.47 0.536 0 C-N-CA 124.551 1.14 . . . . 0.0 112.415 -174.094 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.2 t -81.36 -12.8 58.89 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 122.732 0.413 . . . . 0.0 110.916 -175.204 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 97.3 mt-30 67.19 13.39 9.4 Favored 'General case' 0 N--CA 1.481 1.098 0 C-N-CA 125.3 1.44 . . . . 0.0 112.443 179.365 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -97.07 153.93 38.34 Favored Pre-proline 0 N--CA 1.475 0.799 0 C-N-CA 124.275 1.03 . . . . 0.0 111.086 -173.856 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 26.1 Cg_exo -64.63 135.82 47.1 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.998 2.465 . . . . 0.0 112.285 176.429 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.9 ttmp? -44.51 -46.09 9.62 Favored 'General case' 0 N--CA 1.48 1.07 0 C-N-CA 124.573 1.149 . . . . 0.0 113.296 174.936 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 39.7 mtm105 -60.71 -39.97 90.52 Favored 'General case' 0 N--CA 1.487 1.392 0 C-N-CA 123.208 0.603 . . . . 0.0 112.134 -179.131 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 30.4 tt0 -66.47 -50.81 62.08 Favored 'General case' 0 N--CA 1.474 0.736 0 O-C-N 123.294 0.371 . . . . 0.0 110.521 177.157 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 36.6 mt -57.38 -57.22 13.6 Favored 'General case' 0 N--CA 1.475 0.813 0 O-C-N 124.168 0.918 . . . . 0.0 110.395 -177.377 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.408 ' HA ' HD12 ' A' ' 55' ' ' LEU . 27.8 t-20 -51.03 -52.16 45.87 Favored 'General case' 0 N--CA 1.481 1.111 0 C-N-CA 125.24 1.416 . . . . 0.0 112.097 -177.547 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 26.3 tp60 -57.79 -46.53 84.48 Favored 'General case' 0 N--CA 1.479 1.008 0 C-N-CA 123.188 0.595 . . . . 0.0 111.852 179.152 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.417 HG21 HD12 ' A' ' 20' ' ' LEU . 90.7 t -63.72 -37.55 79.98 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.261 0 O-C-N 123.297 0.373 . . . . 0.0 110.141 179.167 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.522 HD21 HG21 ' A' ' 24' ' ' ILE . 30.3 mt -58.18 -30.67 66.59 Favored 'General case' 0 N--CA 1.473 0.694 0 C-N-CA 124.488 1.115 . . . . 0.0 113.147 -179.424 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . 0.501 ' HA ' ' HG2' ' A' ' 59' ' ' LYS . 18.7 m-85 -75.84 -25.42 56.23 Favored 'General case' 0 N--CA 1.483 1.22 0 CA-C-N 119.348 0.976 . . . . 0.0 111.808 176.156 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.468 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.1 tmt_? -70.11 -50.91 36.01 Favored 'General case' 0 N--CA 1.473 0.724 0 N-CA-C 107.813 -1.18 . . . . 0.0 107.813 171.107 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . . . . . . . . . 85.2 mtp -61.69 -38.82 89.24 Favored 'General case' 0 N--CA 1.474 0.729 0 C-N-CA 124.783 1.233 . . . . 0.0 112.345 -175.335 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.501 ' HG2' ' HA ' ' A' ' 56' ' ' TYR . 17.5 ptpt -65.56 -37.18 85.96 Favored 'General case' 0 N--CA 1.477 0.919 0 CA-C-O 120.785 0.326 . . . . 0.0 111.185 -176.937 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 38.1 ttpt -68.44 -30.67 69.6 Favored 'General case' 0 CA--C 1.54 0.569 0 CA-C-N 115.548 -0.751 . . . . 0.0 110.572 177.722 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.468 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 11.7 mm-40 -80.82 0.46 34.84 Favored 'General case' 0 CA--C 1.558 1.281 0 C-N-CA 123.269 0.627 . . . . 0.0 111.237 176.113 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 68.23 17.44 9.33 Favored 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 125.053 1.341 . . . . 0.0 111.714 -178.52 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.638 ' HB3' HD21 ' A' ' 25' ' ' LEU . 99.4 mttt -77.66 -37.02 50.78 Favored 'General case' 0 N--CA 1.47 0.556 0 C-N-CA 123.347 0.659 . . . . 0.0 111.702 -178.545 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 35.3 m -127.72 146.94 32.58 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.346 0 CA-C-O 121.719 0.771 . . . . 0.0 111.303 178.8 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 28.7 m -109.29 134.05 52.28 Favored 'General case' 0 CA--C 1.536 0.433 0 C-N-CA 124.968 1.307 . . . . 0.0 109.721 175.201 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 55.4 tp -96.85 102.37 14.14 Favored 'General case' 0 C--O 1.239 0.533 0 N-CA-C 106.952 -1.499 . . . . 0.0 106.952 172.996 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . 0.457 HG21 ' HB3' ' A' ' 34' ' ' PRO . 9.3 t -92.91 -32.94 14.4 Favored 'General case' 0 CA--C 1.543 0.679 0 CA-C-N 115.594 -0.73 . . . . 0.0 111.257 -171.53 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.772 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.7 m -139.99 158.0 68.2 Favored Pre-proline 0 N--CA 1.478 0.96 0 CA-C-O 117.23 -1.367 . . . . 0.0 108.101 179.523 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 9.0 Cg_exo -25.57 -70.12 0.04 OUTLIER 'Trans proline' 0 C--N 1.393 2.887 1 C-N-CA 125.589 4.193 . . . . 0.0 116.323 -175.025 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.41 17.19 20.37 Favored 'General case' 0 N--CA 1.491 1.605 0 C-N-CA 123.792 0.837 . . . . 0.0 112.275 176.527 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.772 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 42.2 m -109.22 128.98 55.49 Favored 'General case' 0 N--CA 1.481 1.098 0 CA-C-O 121.345 0.593 . . . . 0.0 110.439 179.348 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.442 ' CE2' HD13 ' A' ' 55' ' ' LEU . 73.9 m95 -112.31 168.19 9.82 Favored 'General case' 0 N--CA 1.469 0.523 0 C-N-CA 124.485 1.114 . . . . 0.0 109.235 -175.242 . . . . . . . . 2 2 . 1 . 012 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 44.6 t -151.36 166.16 31.85 Favored 'General case' 0 C--N 1.325 -0.496 0 C-N-CA 124.673 1.189 . . . . 0.0 108.391 178.134 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 42.6 tp -64.29 133.75 53.34 Favored 'General case' 0 N--CA 1.475 0.816 0 N-CA-C 110.479 -0.193 . . . . 0.0 110.479 175.614 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -69.59 79.08 0.34 Allowed Glycine 0 C--N 1.348 1.223 0 N-CA-C 110.513 -1.035 . . . . 0.0 110.513 172.435 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 132.63 45.38 0.13 Allowed Glycine 0 C--N 1.332 0.343 0 N-CA-C 109.644 -1.382 . . . . 0.0 109.644 -167.834 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 5.7 t -60.72 -29.94 69.66 Favored 'General case' 0 CA--C 1.548 0.873 0 C-N-CA 124.284 1.034 . . . . 0.0 111.652 -176.866 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 11.8 m-20 -60.35 117.91 28.7 Favored Pre-proline 0 CA--C 1.549 0.928 0 C-N-CA 124.058 0.943 . . . . 0.0 110.734 177.778 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 15.6 Cg_exo -68.62 99.17 0.61 Allowed 'Trans proline' 0 C--N 1.38 2.185 0 C-N-CA 122.528 2.152 . . . . 0.0 110.278 175.195 . . . . . . . . 1 1 . 1 . 012 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 6.0 tp10 . . . . . 0 C--O 1.248 1.024 0 CA-C-O 118.701 -0.666 . . . . 0.0 109.345 -169.948 . . . . . . . . 0 0 . 1 . 013 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . 0.434 ' HB3' ' HB3' ' A' ' 5' ' ' HIS . 25.7 mmt . . . . . 0 N--CA 1.482 1.153 0 N-CA-C 109.862 -0.422 . . . . 0.0 109.862 . . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . 0.413 ' O ' ' HB3' ' A' ' 7' ' ' HIS . . . -105.38 -83.56 1.67 Allowed Glycine 0 C--N 1.347 1.164 0 N-CA-C 111.679 -0.568 . . . . 0.0 111.679 178.387 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 20.1 t-80 -69.04 -43.7 74.18 Favored 'General case' 0 N--CA 1.478 0.926 0 C-N-CA 123.183 0.593 . . . . 0.0 109.883 179.367 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 48.8 t-80 -85.01 131.97 34.4 Favored 'General case' 0 N--CA 1.468 0.44 0 CA-C-N 115.319 -0.855 . . . . 0.0 109.214 171.443 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . 0.434 ' HB3' ' HB3' ' A' ' 1' ' ' MET . 50.6 t60 69.57 151.4 0.09 Allowed 'General case' 0 N--CA 1.483 1.225 0 C-N-CA 124.56 1.144 . . . . 0.0 111.364 179.997 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 47.0 t-80 -45.05 102.77 0.03 OUTLIER 'General case' 0 N--CA 1.482 1.17 0 C-N-CA 124.897 1.279 . . . . 0.0 111.999 178.862 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . 0.413 ' HB3' ' O ' ' A' ' 2' ' ' GLY . 29.3 p80 -65.74 150.11 49.04 Favored 'General case' 0 N--CA 1.477 0.906 0 CA-C-N 115.199 -0.91 . . . . 0.0 110.413 177.388 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 10.2 p80 -146.89 -60.42 0.29 Allowed 'General case' 0 CA--C 1.546 0.801 0 C-N-CA 122.634 0.374 . . . . 0.0 111.68 -176.498 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 28.3 t 58.57 -160.55 0.26 Allowed 'General case' 0 N--CA 1.493 1.679 0 C-N-CA 123.701 0.801 . . . . 0.0 110.745 -175.03 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 92.0 m-70 -127.78 -69.58 0.73 Allowed 'General case' 0 N--CA 1.478 0.951 0 N-CA-C 108.757 -0.831 . . . . 0.0 108.757 171.493 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 49.6 ttp -170.69 -28.88 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.287 0 C-N-CA 123.209 0.604 . . . . 0.0 111.501 -177.09 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -50.94 111.4 0.55 Allowed 'General case' 0 N--CA 1.48 1.06 0 C-N-CA 124.414 1.086 . . . . 0.0 112.178 -170.789 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 4.8 m-20 -63.76 136.81 96.88 Favored Pre-proline 0 N--CA 1.477 0.918 0 C-N-CA 124.561 1.145 . . . . 0.0 111.288 -171.306 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 67.9 Cg_endo -71.2 77.11 1.64 Allowed 'Trans proline' 0 C--N 1.382 2.302 0 C-N-CA 123.098 2.532 . . . . 0.0 111.576 177.414 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -173.46 155.24 21.93 Favored Glycine 0 C--O 1.249 1.036 0 N-CA-C 107.931 -2.068 . . . . 0.0 107.931 -175.622 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . 0.426 ' O ' ' HB2' ' A' ' 20' ' ' LEU . 34.2 ptt180 -59.39 -35.93 74.85 Favored 'General case' 0 CA--C 1.55 0.969 0 N-CA-C 112.5 0.556 . . . . 0.0 112.5 -172.535 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . 0.408 ' HG3' HG22 ' A' ' 54' ' ' VAL . 44.8 tt0 -68.85 -57.01 6.16 Favored 'General case' 0 N--CA 1.48 1.068 0 C-N-CA 124.042 0.937 . . . . 0.0 112.619 -173.608 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.462 ' O ' ' HG2' ' A' ' 22' ' ' GLN . . . -55.63 -38.16 70.66 Favored Glycine 0 C--N 1.348 1.249 0 O-C-N 123.242 0.339 . . . . 0.0 113.797 178.994 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 48.2 m170 -73.6 -36.56 65.53 Favored 'General case' 0 N--CA 1.477 0.9 0 C-N-CA 123.02 0.528 . . . . 0.0 110.648 178.8 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.58 HD11 HD23 ' A' ' 51' ' ' LEU . 2.4 tm? -62.52 -45.39 93.2 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 124.202 1.001 . . . . 0.0 109.905 177.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 37.2 tt0 -58.34 -44.78 88.89 Favored 'General case' 0 N--CA 1.474 0.772 0 C-N-CA 124.498 1.119 . . . . 0.0 110.444 176.444 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 18' ' ' GLY . 15.9 mm100 -60.02 -39.79 87.08 Favored 'General case' 0 C--O 1.24 0.573 0 O-C-N 124.059 0.849 . . . . 0.0 111.953 179.736 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.417 ' O ' HG23 ' A' ' 27' ' ' VAL . 23.0 tpt180 -68.37 -41.71 80.22 Favored 'General case' 0 C--N 1.353 0.724 0 CA-C-O 119.64 -0.219 . . . . 0.0 110.691 179.744 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 66.5 mt -61.51 -47.69 92.22 Favored 'Isoleucine or valine' 0 C--N 1.358 0.956 0 O-C-N 123.316 0.385 . . . . 0.0 110.202 178.759 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.498 HD21 ' HB3' ' A' ' 63' ' ' LYS . 95.8 mt -52.69 -44.06 66.01 Favored 'General case' 0 N--CA 1.485 1.279 0 C-N-CA 123.749 0.82 . . . . 0.0 111.923 174.654 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 39.8 tt0 -65.15 -54.7 25.78 Favored 'General case' 0 N--CA 1.474 0.74 0 O-C-N 123.78 0.675 . . . . 0.0 110.768 -177.527 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.417 HG23 ' O ' ' A' ' 23' ' ' ARG . 90.5 t -56.25 -45.86 81.27 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.061 0 C-N-CA 124.187 0.995 . . . . 0.0 111.434 -177.056 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.604 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 96.9 mt -64.79 -35.84 82.4 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 123.637 0.586 . . . . 0.0 111.536 -179.945 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.1 m -66.45 -46.18 77.32 Favored 'General case' 0 N--CA 1.477 0.905 0 C-N-CA 122.874 0.469 . . . . 0.0 111.043 176.355 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 47.8 mt-10 -68.53 -40.33 80.78 Favored 'General case' 0 N--CA 1.474 0.771 0 C-N-CA 123.153 0.581 . . . . 0.0 111.184 -174.229 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.36 -38.55 87.84 Favored 'General case' 0 C--O 1.24 0.553 0 C-N-CA 123.006 0.523 . . . . 0.0 110.318 172.318 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.12 37.55 94.13 Favored Glycine 0 C--N 1.354 1.533 0 CA-C-N 115.369 -0.832 . . . . 0.0 112.084 -177.587 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.1 t -164.6 152.09 10.21 Favored Pre-proline 0 CA--C 1.549 0.924 0 C-N-CA 123.501 0.72 . . . . 0.0 109.682 -167.488 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 80.7 Cg_exo -50.26 126.53 17.66 Favored 'Trans proline' 0 C--N 1.374 1.89 0 C-N-CA 123.14 2.56 . . . . 0.0 113.177 168.336 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 69.0 t -118.22 128.87 75.2 Favored 'Isoleucine or valine' 0 N--CA 1.474 0.732 0 C-N-CA 124.364 1.066 . . . . 0.0 108.31 179.501 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.561 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 56.4 mtmt -65.11 150.63 47.81 Favored 'General case' 0 N--CA 1.476 0.857 0 O-C-N 123.366 0.416 . . . . 0.0 110.401 176.152 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.444 ' O ' HG23 ' A' ' 41' ' ' VAL . 22.6 tp -61.94 -46.94 87.14 Favored 'General case' 0 CA--C 1.54 0.594 0 O-C-N 123.648 0.593 . . . . 0.0 110.761 176.46 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.68 -31.54 26.22 Favored 'General case' 0 CA--C 1.555 1.147 0 N-CA-C 112.929 0.715 . . . . 0.0 112.929 171.183 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.444 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 64.3 tt0 -80.24 -37.0 33.9 Favored 'General case' 0 N--CA 1.478 0.952 0 C-N-CA 122.668 0.387 . . . . 0.0 110.292 174.436 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 60.2 mt -59.03 -31.85 69.2 Favored 'General case' 0 N--CA 1.481 1.116 0 C-N-CA 123.619 0.767 . . . . 0.0 110.774 178.656 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.49 ' HA ' HD11 ' A' ' 51' ' ' LEU . 25.0 t -54.72 -54.2 25.21 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.055 0 O-C-N 123.512 0.507 . . . . 0.0 111.493 176.807 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.6 pttt -74.6 -44.66 49.65 Favored 'General case' 0 CA--C 1.548 0.89 0 O-C-N 123.452 0.47 . . . . 0.0 111.965 -177.535 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.444 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 34.0 mm-40 -59.26 -54.87 41.93 Favored 'General case' 0 N--CA 1.486 1.337 0 N-CA-C 112.708 0.633 . . . . 0.0 112.708 179.081 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 49.3 t -75.21 -16.53 60.48 Favored 'General case' 0 N--CA 1.474 0.753 0 C-N-CA 123.233 0.613 . . . . 0.0 111.105 -178.711 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 69.9 mt-30 65.21 23.17 12.24 Favored 'General case' 0 N--CA 1.487 1.405 0 C-N-CA 125.2 1.4 . . . . 0.0 112.253 177.795 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -115.17 151.01 45.3 Favored Pre-proline 0 CA--C 1.544 0.748 0 C-N-CA 124.115 0.966 . . . . 0.0 109.831 -178.485 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.62 ' HB2' ' HG2' ' A' ' 49' ' ' ARG . 19.9 Cg_endo -59.75 136.59 71.43 Favored 'Trans proline' 0 C--N 1.375 1.944 0 C-N-CA 122.681 2.254 . . . . 0.0 111.921 174.61 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 27.0 ttpp -47.95 -33.24 7.43 Favored 'General case' 0 N--CA 1.479 0.988 0 C-N-CA 124.991 1.316 . . . . 0.0 113.285 176.15 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.62 ' HG2' ' HB2' ' A' ' 47' ' ' PRO . 14.2 ptp180 -59.78 -46.31 89.57 Favored 'General case' 0 N--CA 1.481 1.103 0 C-N-CA 123.177 0.591 . . . . 0.0 111.037 177.218 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.481 ' HG3' ' HG ' ' A' ' 20' ' ' LEU . 10.3 tp10 -67.09 -49.96 63.22 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 123.98 0.912 . . . . 0.0 110.521 -178.993 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.58 HD23 HD11 ' A' ' 20' ' ' LEU . 48.2 mt -56.45 -54.07 50.01 Favored 'General case' 0 C--O 1.213 -0.867 0 CA-C-N 115.117 -0.947 . . . . 0.0 111.93 -179.362 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 28.9 t-20 -51.29 -49.51 61.12 Favored 'General case' 0 N--CA 1.478 0.927 0 C-N-CA 125.084 1.353 . . . . 0.0 112.171 -176.745 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 60.7 tt0 -61.08 -49.26 78.05 Favored 'General case' 0 C--N 1.352 0.709 0 O-C-N 123.88 0.738 . . . . 0.0 111.821 179.972 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.424 ' O ' ' HG3' ' A' ' 58' ' ' MET . 78.1 t -68.82 -36.83 76.06 Favored 'Isoleucine or valine' 0 CA--C 1.551 0.992 0 C-N-CA 122.545 0.338 . . . . 0.0 110.785 -176.876 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 37.4 mt -52.68 -37.88 59.56 Favored 'General case' 0 N--CA 1.481 1.102 0 C-N-CA 124.319 1.048 . . . . 0.0 112.917 173.078 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 29.5 m-85 -70.16 -31.48 68.99 Favored 'General case' 0 N--CA 1.473 0.708 0 CA-C-N 118.642 0.655 . . . . 0.0 111.513 176.654 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 5.7 ttt180 -64.1 -52.43 59.25 Favored 'General case' 0 N--CA 1.472 0.667 0 N-CA-C 108.687 -0.857 . . . . 0.0 108.687 173.616 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.424 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 74.9 mtp -62.02 -33.44 74.37 Favored 'General case' 0 C--N 1.356 0.877 0 C-N-CA 124.152 0.981 . . . . 0.0 111.336 -178.538 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 82.7 tttt -62.42 -42.31 99.35 Favored 'General case' 0 N--CA 1.476 0.835 0 C-N-CA 123.574 0.749 . . . . 0.0 111.908 175.233 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.5 mptp? -69.52 -22.56 63.58 Favored 'General case' 0 N--CA 1.481 1.082 0 C-N-CA 123.267 0.627 . . . . 0.0 111.273 173.533 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.406 ' HB3' ' HE3' ' A' ' 63' ' ' LYS . 18.6 mm-40 -89.1 -0.28 57.31 Favored 'General case' 0 CA--C 1.548 0.871 0 C-N-CA 123.446 0.698 . . . . 0.0 111.309 173.079 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.9 mm? 65.48 11.17 7.19 Favored 'General case' 0 N--CA 1.496 1.831 0 C-N-CA 125.027 1.331 . . . . 0.0 112.43 178.787 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.498 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.7 mttt -74.53 -34.82 63.09 Favored 'General case' 0 N--CA 1.47 0.55 0 C-N-CA 123.869 0.868 . . . . 0.0 111.2 -178.836 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 24.4 m -128.9 147.07 33.33 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.693 0 C-N-CA 123.229 0.612 . . . . 0.0 109.637 175.49 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . 0.631 ' HB2' ' SG ' ' A' ' 73' ' ' CYS . 49.0 m -121.0 156.28 32.48 Favored 'General case' 0 C--N 1.33 -0.272 0 C-N-CA 123.962 0.905 . . . . 0.0 109.459 176.099 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 53.7 tp -104.17 103.31 13.07 Favored 'General case' 0 N--CA 1.469 0.5 0 N-CA-C 106.585 -1.635 . . . . 0.0 106.585 176.709 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 2.7 t -95.68 -36.4 11.22 Favored 'General case' 0 N--CA 1.482 1.166 0 C-N-CA 123.366 0.666 . . . . 0.0 111.127 -169.143 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.567 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 50.1 m -139.34 166.8 21.89 Favored Pre-proline 0 CA--C 1.555 1.151 0 C-N-CA 123.584 0.754 . . . . 0.0 109.469 -176.988 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.1 Cg_exo -51.06 106.92 0.15 Allowed 'Trans proline' 0 C--N 1.39 2.731 0 C-N-CA 123.177 2.585 . . . . 0.0 113.195 179.004 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 66.11 21.31 11.19 Favored 'General case' 0 N--CA 1.482 1.134 0 C-N-CA 124.569 1.148 . . . . 0.0 111.933 178.557 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.567 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 29.2 m -120.14 122.75 41.71 Favored 'General case' 0 C--O 1.246 0.875 0 C-N-CA 123.937 0.895 . . . . 0.0 108.771 -177.849 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 82.0 m95 -106.99 169.01 8.81 Favored 'General case' 0 C--N 1.329 -0.291 0 N-CA-C 108.978 -0.749 . . . . 0.0 108.978 -176.92 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.631 ' SG ' ' HB2' ' A' ' 65' ' ' SER . 24.6 p -150.74 158.49 44.21 Favored 'General case' 0 C--N 1.322 -0.621 0 N-CA-C 108.55 -0.907 . . . . 0.0 108.55 -179.575 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.604 ' HB2' ' HB3' ' A' ' 28' ' ' LEU . 18.7 tp -78.26 105.07 9.25 Favored 'General case' 0 CA--C 1.538 0.485 0 N-CA-C 108.548 -0.908 . . . . 0.0 108.548 178.454 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -64.07 -58.58 10.34 Favored Glycine 0 C--N 1.345 1.033 0 O-C-N 123.843 0.715 . . . . 0.0 111.327 176.774 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.18 79.03 1.95 Allowed Glycine 0 C--N 1.34 0.756 0 N-CA-C 110.205 -1.158 . . . . 0.0 110.205 171.842 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.402 ' HA ' HD23 ' A' ' 74' ' ' LEU . 7.7 m -69.87 85.64 0.5 Allowed 'General case' 0 N--CA 1.474 0.775 0 C-N-CA 123.742 0.817 . . . . 0.0 111.579 -173.354 . . . . . . . . 2 2 . 1 . 013 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 20.5 t70 55.47 68.69 2.31 Favored Pre-proline 0 CA--C 1.557 1.219 0 C-N-CA 124.892 1.277 . . . . 0.0 110.879 177.256 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 75.1 Cg_endo -73.54 94.85 0.85 Allowed 'Trans proline' 0 C--N 1.372 1.801 0 C-N-CA 122.752 2.301 . . . . 0.0 113.968 -168.265 . . . . . . . . 1 1 . 1 . 013 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 5.9 pt-20 . . . . . 0 CA--C 1.557 1.229 0 CA-C-O 118.542 -0.742 . . . . 0.0 110.389 175.445 . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 57.7 mtt . . . . . 0 N--CA 1.482 1.169 0 N-CA-C 109.072 -0.714 . . . . 0.0 109.072 . . . . . . . . . 0 0 . 1 . 014 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -143.15 19.79 2.3 Favored Glycine 0 C--N 1.353 1.473 0 CA-C-O 119.967 -0.351 . . . . 0.0 113.754 -174.648 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 47.6 p-80 -123.84 111.88 16.62 Favored 'General case' 0 N--CA 1.469 0.501 0 N-CA-C 108.929 -0.767 . . . . 0.0 108.929 172.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 5.7 t-160 -104.33 -5.39 21.83 Favored 'General case' 0 N--CA 1.478 0.96 0 N-CA-C 109.641 -0.503 . . . . 0.0 109.641 174.006 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 86.4 t60 -110.41 92.0 3.88 Favored 'General case' 0 C--O 1.24 0.574 0 N-CA-C 108.697 -0.853 . . . . 0.0 108.697 175.982 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 67.2 t60 -156.34 11.93 0.28 Allowed 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 124.408 1.083 . . . . 0.0 109.222 179.399 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 20.4 t-160 -57.05 -69.54 0.15 Allowed 'General case' 0 C--N 1.357 0.899 0 C-N-CA 123.698 0.799 . . . . 0.0 111.485 -168.729 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 40.2 m80 58.76 -75.86 0.02 OUTLIER 'General case' 0 N--CA 1.485 1.291 0 C-N-CA 125.015 1.326 . . . . 0.0 112.093 179.06 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 54.1 m -49.14 127.49 14.67 Favored 'General case' 0 N--CA 1.478 0.93 0 C-N-CA 125.088 1.355 . . . . 0.0 112.574 178.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 36.5 m-70 -88.31 29.79 0.94 Allowed 'General case' 0 N--CA 1.485 1.3 0 C-N-CA 123.924 0.89 . . . . 0.0 111.836 -175.317 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 50.0 ttm -138.98 -58.84 0.6 Allowed 'General case' 0 N--CA 1.475 0.799 0 C-N-CA 123.672 0.789 . . . . 0.0 109.091 177.643 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.26 87.25 1.97 Allowed 'General case' 0 N--CA 1.474 0.77 0 C-N-CA 123.358 0.663 . . . . 0.0 110.692 179.808 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 32.7 t70 -83.6 135.67 43.17 Favored Pre-proline 0 CA--C 1.547 0.831 0 C-N-CA 123.763 0.825 . . . . 0.0 109.945 179.551 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 62.4 Cg_endo -79.68 4.56 6.58 Favored 'Trans proline' 0 C--N 1.374 1.912 0 C-N-CA 123.2 2.6 . . . . 0.0 113.302 -179.0 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -29.25 89.77 0.01 OUTLIER Glycine 0 C--N 1.356 1.658 0 O-C-N 125.285 1.615 . . . . 0.0 114.697 174.915 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 25.4 mtp-105 -54.4 -15.27 1.56 Allowed 'General case' 0 N--CA 1.488 1.428 0 N-CA-C 115.881 1.808 . . . . 0.0 115.881 -168.41 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 34.9 mt-10 -56.11 -43.31 78.0 Favored 'General case' 0 N--CA 1.471 0.593 0 N-CA-C 113.166 0.802 . . . . 0.0 113.166 -156.763 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.411 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -69.81 -40.27 75.47 Favored Glycine 0 C--N 1.35 1.33 0 N-CA-C 115.541 0.976 . . . . 0.0 115.541 177.253 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 44.3 m80 -72.89 -37.95 67.13 Favored 'General case' 0 N--CA 1.49 1.55 0 CA-C-O 122.006 0.908 . . . . 0.0 110.149 -179.734 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.648 HD11 HD23 ' A' ' 51' ' ' LEU . 3.0 tm? -66.15 -36.43 83.11 Favored 'General case' 0 CA--C 1.55 0.961 0 CA-C-N 113.378 -1.737 . . . . 0.0 110.156 174.247 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.421 ' HG3' ' HG2' ' A' ' 58' ' ' MET . 34.6 tt0 -60.64 -46.16 91.35 Favored 'General case' 0 N--CA 1.484 1.247 0 C-N-CA 124.316 1.046 . . . . 0.0 110.32 174.105 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.411 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 69.8 mt-30 -65.98 -32.62 74.21 Favored 'General case' 0 N--CA 1.472 0.66 0 CA-C-N 114.805 -1.088 . . . . 0.0 110.438 179.405 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.503 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.0 OUTLIER -66.74 -48.66 68.45 Favored 'General case' 0 CA--C 1.547 0.835 0 C-N-CA 123.48 0.712 . . . . 0.0 109.353 176.949 . . . . . . . . 3 3 . 1 . 014 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.437 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 86.2 mt -57.65 -49.17 81.5 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.974 0 O-C-N 124.275 0.984 . . . . 0.0 109.878 179.448 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.509 HD21 ' HB3' ' A' ' 63' ' ' LYS . 78.2 mt -55.8 -40.15 72.32 Favored 'General case' 0 C--N 1.358 0.968 0 C-N-CA 123.596 0.758 . . . . 0.0 110.832 178.935 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.3 tt0 -70.87 -41.48 71.31 Favored 'General case' 0 CA--C 1.543 0.697 0 O-C-N 123.865 0.728 . . . . 0.0 110.692 -176.263 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.503 HG23 ' O ' ' A' ' 23' ' ' ARG . 60.5 t -54.69 -46.34 73.4 Favored 'Isoleucine or valine' 0 N--CA 1.49 1.559 0 C-N-CA 123.298 0.639 . . . . 0.0 110.221 174.692 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.437 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 71.2 mt -65.26 -39.76 93.08 Favored 'General case' 0 CA--C 1.546 0.807 0 CA-C-N 114.365 -1.289 . . . . 0.0 111.253 -178.665 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -69.58 -48.48 60.04 Favored 'General case' 0 N--CA 1.472 0.667 0 C-N-CA 124.279 1.032 . . . . 0.0 112.043 -177.472 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 45.4 mt-10 -66.99 -36.15 81.54 Favored 'General case' 0 N--CA 1.475 0.817 0 C-N-CA 123.616 0.766 . . . . 0.0 110.237 -176.703 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -65.18 -44.73 87.51 Favored 'General case' 0 N--CA 1.468 0.427 0 CA-C-N 115.396 -0.82 . . . . 0.0 110.782 171.983 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 65.16 24.31 70.34 Favored Glycine 0 CA--C 1.531 1.041 0 CA-C-N 114.791 -1.095 . . . . 0.0 111.951 -171.272 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 49.5 m -153.35 149.56 21.75 Favored Pre-proline 0 CA--C 1.544 0.724 0 C-N-CA 124.413 1.085 . . . . 0.0 109.36 -171.975 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 45.2 Cg_exo -55.17 114.66 1.97 Allowed 'Trans proline' 0 C--N 1.376 2.02 0 C-N-CA 122.533 2.156 . . . . 0.0 112.277 177.333 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.449 HG21 HG12 ' A' ' 27' ' ' VAL . 91.7 t -96.04 131.5 42.66 Favored 'Isoleucine or valine' 0 N--CA 1.467 0.422 0 C-N-CA 123.777 0.831 . . . . 0.0 108.924 -179.42 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.503 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 46.2 mtpt -73.12 151.27 41.66 Favored 'General case' 0 N--CA 1.47 0.529 0 C-N-CA 123.04 0.536 . . . . 0.0 109.943 -178.996 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.484 ' O ' HG23 ' A' ' 41' ' ' VAL . 36.2 tp -54.09 -44.74 71.47 Favored 'General case' 0 N--CA 1.472 0.627 0 O-C-N 124.394 1.058 . . . . 0.0 111.199 178.515 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -44.89 -49.18 11.11 Favored 'General case' 0 N--CA 1.477 0.887 0 C-N-CA 124.043 0.937 . . . . 0.0 112.627 170.561 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.43 ' HA ' ' HG2' ' A' ' 42' ' ' LYS . 52.1 tt0 -77.07 -28.18 54.55 Favored 'General case' 0 CA--C 1.543 0.707 0 C-N-CA 122.595 0.358 . . . . 0.0 110.807 179.722 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 92.0 mt -63.14 -32.27 73.61 Favored 'General case' 0 N--CA 1.479 1.009 0 C-N-CA 122.336 0.255 . . . . 0.0 110.358 174.226 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.553 ' HA ' HD11 ' A' ' 51' ' ' LEU . 61.2 t -59.68 -55.44 23.89 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.074 0 C-N-CA 123.302 0.641 . . . . 0.0 110.786 175.137 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . 0.43 ' HG2' ' HA ' ' A' ' 39' ' ' GLN . 20.3 ptmt -69.9 -42.26 73.63 Favored 'General case' 0 CA--C 1.548 0.868 0 CA-C-N 116.228 -0.442 . . . . 0.0 111.601 -174.018 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 10.7 mm-40 -72.47 -36.25 68.41 Favored 'General case' 0 N--CA 1.479 0.986 0 N-CA-C 113.213 0.82 . . . . 0.0 113.213 -177.71 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 78.8 m -83.75 -17.04 42.55 Favored 'General case' 0 N--CA 1.48 1.039 0 CA-C-N 117.866 0.303 . . . . 0.0 111.443 175.42 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 54.7 mt-30 58.94 27.53 16.4 Favored 'General case' 0 N--CA 1.489 1.49 0 C-N-CA 124.533 1.133 . . . . 0.0 111.82 179.546 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -119.68 154.9 54.98 Favored Pre-proline 0 C--O 1.245 0.854 0 C-N-CA 124.283 1.033 . . . . 0.0 109.963 -174.433 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 32.8 Cg_endo -63.43 131.13 30.66 Favored 'Trans proline' 0 C--N 1.375 1.935 0 C-N-CA 122.504 2.136 . . . . 0.0 111.864 177.916 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.544 ' HA ' HD12 ' A' ' 51' ' ' LEU . 40.5 ttmt -45.23 -41.05 8.0 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 125.486 1.515 . . . . 0.0 113.239 178.811 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 68.1 mtm-85 -53.81 -49.4 68.45 Favored 'General case' 0 N--CA 1.479 0.985 0 C-N-CA 123.816 0.846 . . . . 0.0 111.264 178.39 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 37.9 tt0 -62.97 -44.25 96.56 Favored 'General case' 0 C--O 1.249 1.075 0 C-N-CA 123.467 0.707 . . . . 0.0 110.773 179.062 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.648 HD23 HD11 ' A' ' 20' ' ' LEU . 75.1 mt -54.73 -51.07 66.78 Favored 'General case' 0 C--N 1.353 0.723 0 O-C-N 124.513 1.133 . . . . 0.0 110.671 -179.9 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 14.1 m120 -51.38 -54.73 23.61 Favored 'General case' 0 N--CA 1.481 1.084 0 O-C-N 124.257 0.973 . . . . 0.0 112.311 179.97 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 1.3 mp0 -53.57 -44.89 69.68 Favored 'General case' 0 N--CA 1.482 1.155 0 N-CA-C 111.936 0.347 . . . . 0.0 111.936 -179.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.663 HG12 ' SD ' ' A' ' 58' ' ' MET . 94.8 t -66.37 -51.1 62.06 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.046 0 C-N-CA 122.869 0.467 . . . . 0.0 110.789 179.177 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.437 HD13 ' NE1' ' A' ' 72' ' ' TRP . 57.7 mt -48.63 -49.62 36.39 Favored 'General case' 0 N--CA 1.489 1.505 0 C-N-CA 125.509 1.524 . . . . 0.0 114.537 -176.744 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 80.9 m-85 -69.35 -29.43 67.23 Favored 'General case' 0 N--CA 1.474 0.766 0 C-N-CA 122.451 0.301 . . . . 0.0 111.421 -176.944 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 56.5 ttt180 -67.57 -47.76 68.86 Favored 'General case' 0 N--CA 1.475 0.781 0 N-CA-C 109.381 -0.599 . . . . 0.0 109.381 174.069 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.663 ' SD ' HG12 ' A' ' 54' ' ' VAL . 73.2 mtp -60.58 -34.06 73.62 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.908 0.883 . . . . 0.0 110.927 179.714 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . 0.404 ' HB2' ' HZ3' ' A' ' 72' ' ' TRP . 58.2 tttm -64.78 -42.62 94.93 Favored 'General case' 0 N--CA 1.477 0.879 0 C-N-CA 123.748 0.819 . . . . 0.0 110.82 177.28 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 31.3 ttpt -59.91 -44.05 94.51 Favored 'General case' 0 N--CA 1.479 1.016 0 C-N-CA 123.74 0.816 . . . . 0.0 110.423 172.819 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 45.3 mt-10 -78.92 -1.28 34.5 Favored 'General case' 0 CA--C 1.548 0.878 0 C-N-CA 123.78 0.832 . . . . 0.0 111.469 -179.305 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 80.0 mt 62.93 15.72 8.58 Favored 'General case' 0 N--CA 1.486 1.355 0 C-N-CA 125.343 1.457 . . . . 0.0 112.28 177.843 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.509 ' HB3' HD21 ' A' ' 25' ' ' LEU . 92.4 mttt -67.96 -33.24 74.27 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 124.573 1.149 . . . . 0.0 109.868 173.463 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 28.9 m -129.1 169.43 20.43 Favored 'Isoleucine or valine' 0 N--CA 1.475 0.798 0 C-N-CA 123.265 0.626 . . . . 0.0 109.451 173.498 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 21.9 t -134.05 147.32 50.91 Favored 'General case' 0 CA--C 1.535 0.389 0 N-CA-C 107.632 -1.247 . . . . 0.0 107.632 176.638 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 60.4 tp -100.54 106.28 17.78 Favored 'General case' 0 N--CA 1.475 0.784 0 N-CA-C 107.694 -1.224 . . . . 0.0 107.694 178.698 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 35.1 p -93.7 -34.29 13.3 Favored 'General case' 0 N--CA 1.479 0.983 0 C-N-CA 123.636 0.774 . . . . 0.0 111.772 -172.656 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.663 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 47.6 t -141.15 154.65 68.07 Favored Pre-proline 0 CA--C 1.551 0.981 0 N-CA-C 107.179 -1.415 . . . . 0.0 107.179 -179.393 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 47.8 Cg_exo -21.68 -67.52 0.03 OUTLIER 'Trans proline' 0 C--N 1.394 2.957 1 C-N-CA 125.594 4.196 . . . . 0.0 116.513 -177.149 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -123.08 51.69 1.42 Allowed 'General case' 0 N--CA 1.478 0.937 0 CA-C-O 121.489 0.661 . . . . 0.0 110.538 173.218 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.663 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 69.3 m -131.87 128.57 38.9 Favored 'General case' 0 C--O 1.243 0.711 0 C-N-CA 123.647 0.779 . . . . 0.0 109.541 172.045 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.437 ' NE1' HD13 ' A' ' 55' ' ' LEU . 75.2 m95 -117.67 142.22 47.49 Favored 'General case' 0 N--CA 1.469 0.525 0 C-N-CA 123.789 0.836 . . . . 0.0 109.701 -174.598 . . . . . . . . 2 2 . 1 . 014 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 38.7 t -115.87 166.31 12.11 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.585 0.754 . . . . 0.0 109.848 173.87 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 41.3 tp -68.83 129.6 40.39 Favored 'General case' 0 CA--C 1.541 0.617 0 C-N-CA 123.708 0.803 . . . . 0.0 109.428 174.861 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -72.02 92.76 0.56 Allowed Glycine 0 CA--C 1.525 0.684 0 N-CA-C 111.369 -0.692 . . . . 0.0 111.369 175.821 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 86.68 178.89 49.24 Favored Glycine 0 C--N 1.345 1.057 0 N-CA-C 111.853 -0.499 . . . . 0.0 111.853 -175.039 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 44.7 m -78.52 -44.43 24.4 Favored 'General case' 0 N--CA 1.478 0.961 0 CA-C-O 121.457 0.646 . . . . 0.0 109.763 178.829 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 30.1 t70 -133.32 137.03 28.26 Favored Pre-proline 0 CA--C 1.544 0.724 0 CA-C-N 114.844 -1.071 . . . . 0.0 110.131 -176.074 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 57.1 Cg_endo -73.52 113.71 3.85 Favored 'Trans proline' 0 C--N 1.372 1.764 0 C-N-CA 122.352 2.035 . . . . 0.0 111.064 171.046 . . . . . . . . 1 1 . 1 . 014 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.0 OUTLIER . . . . . 0 C--O 1.253 1.249 0 CA-C-O 118.724 -0.655 . . . . 0.0 109.994 -179.735 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 71.0 mtm . . . . . 0 N--CA 1.48 1.074 0 N-CA-C 109.867 -0.42 . . . . 0.0 109.867 . . . . . . . . . 0 0 . 1 . 015 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -75.03 -27.05 65.13 Favored Glycine 0 C--N 1.355 1.588 0 CA-C-N 116.029 -0.532 . . . . 0.0 113.465 -176.617 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 35.3 m170 -76.35 -0.53 22.94 Favored 'General case' 0 N--CA 1.481 1.081 0 C-N-CA 123.233 0.613 . . . . 0.0 112.127 177.389 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 34.2 t60 -67.83 141.66 56.4 Favored 'General case' 0 CA--C 1.546 0.795 0 N-CA-C 108.887 -0.783 . . . . 0.0 108.887 173.509 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.1 m170 68.28 97.56 0.06 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.719 1.208 . . . . 0.0 109.236 -169.18 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 81.4 t60 -70.85 116.7 11.46 Favored 'General case' 0 N--CA 1.473 0.699 0 C-N-CA 123.109 0.563 . . . . 0.0 110.754 -176.23 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 24.1 p80 -94.13 165.78 12.45 Favored 'General case' 0 N--CA 1.477 0.917 0 C-N-CA 123.738 0.815 . . . . 0.0 109.759 170.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 1.0 OUTLIER -153.7 160.91 42.49 Favored 'General case' 0 N--CA 1.481 1.124 0 C-N-CA 123.11 0.564 . . . . 0.0 110.278 177.339 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 47.2 t -115.85 125.2 52.34 Favored 'General case' 0 N--CA 1.47 0.546 0 C-N-CA 123.897 0.879 . . . . 0.0 108.951 179.313 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 68.1 t60 -65.23 -53.03 50.57 Favored 'General case' 0 N--CA 1.473 0.706 0 C-N-CA 123.78 0.832 . . . . 0.0 110.635 -176.131 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 21.9 ptm -84.47 72.36 10.63 Favored 'General case' 0 CA--C 1.55 0.966 0 CA-C-O 122.409 1.099 . . . . 0.0 109.726 175.542 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -160.48 21.56 0.15 Allowed 'General case' 0 N--CA 1.474 0.735 0 CA-C-N 114.752 -1.113 . . . . 0.0 110.028 -179.861 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 76.6 115.68 0.03 OUTLIER Pre-proline 0 N--CA 1.491 1.588 0 C-N-CA 126.222 1.809 . . . . 0.0 110.226 -172.572 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 9.8 Cg_endo -51.54 -36.94 61.66 Favored 'Trans proline' 0 C--N 1.386 2.552 0 C-N-CA 123.591 2.86 . . . . 0.0 112.732 173.078 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -153.6 114.15 0.61 Allowed Glycine 0 C--N 1.337 0.609 0 N-CA-C 107.999 -2.04 . . . . 0.0 107.999 167.249 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 7.5 mpt_? -59.39 -34.36 72.34 Favored 'General case' 0 N--CA 1.487 1.417 0 C-N-CA 123.709 0.804 . . . . 0.0 112.014 -169.156 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 1.0 OUTLIER -63.47 -50.61 69.01 Favored 'General case' 0 N--CA 1.469 0.487 0 C-N-CA 123.737 0.815 . . . . 0.0 109.67 -178.123 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.404 ' O ' ' HB2' ' A' ' 22' ' ' GLN . . . -51.51 -38.22 42.44 Favored Glycine 0 C--N 1.346 1.117 0 O-C-N 123.77 0.669 . . . . 0.0 114.442 177.288 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 15.3 t-80 -83.39 -32.62 26.07 Favored 'General case' 0 N--CA 1.472 0.647 0 C-N-CA 122.393 0.277 . . . . 0.0 110.817 -178.413 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.576 HD11 ' HA ' ' A' ' 51' ' ' LEU . 0.8 OUTLIER -60.35 -53.11 61.54 Favored 'General case' 0 CA--C 1.551 1.002 0 C-N-CA 124.454 1.102 . . . . 0.0 108.937 178.433 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.757 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 32.6 tt0 -59.48 -47.46 85.41 Favored 'General case' 0 CA--C 1.542 0.65 0 CA-C-N 114.85 -1.068 . . . . 0.0 110.551 176.011 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.404 ' HB2' ' O ' ' A' ' 18' ' ' GLY . 0.0 OUTLIER -60.59 -41.18 94.17 Favored 'General case' 0 N--CA 1.484 1.242 0 O-C-N 123.784 0.678 . . . . 0.0 109.963 -173.463 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.405 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.5 OUTLIER -64.51 -49.62 70.62 Favored 'General case' 0 C--N 1.346 0.426 0 C-N-CA 123.666 0.787 . . . . 0.0 111.968 -178.941 . . . . . . . . 3 3 . 1 . 015 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . . . . . . . . . 76.1 mt -58.62 -49.52 82.25 Favored 'Isoleucine or valine' 0 N--CA 1.472 0.653 0 O-C-N 124.056 0.848 . . . . 0.0 110.152 -177.779 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 97.0 mt -62.51 -38.76 91.18 Favored 'General case' 0 C--N 1.35 0.621 0 C-N-CA 123.586 0.754 . . . . 0.0 111.286 -176.879 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 64.0 tt0 -70.92 -41.41 71.25 Favored 'General case' 0 CA--C 1.542 0.641 0 O-C-N 123.47 0.481 . . . . 0.0 110.573 -176.693 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.405 HG23 ' O ' ' A' ' 23' ' ' ARG . 86.7 t -63.31 -37.52 79.71 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.125 0 C-N-CA 123.105 0.562 . . . . 0.0 110.338 176.68 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.511 HD22 ' HA ' ' A' ' 73' ' ' CYS . 89.5 mt -71.09 -28.94 64.7 Favored 'General case' 0 CA--C 1.549 0.935 0 C-N-CA 122.767 0.427 . . . . 0.0 111.123 177.674 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 99.0 m -73.6 -49.58 25.49 Favored 'General case' 0 N--CA 1.474 0.745 0 C-N-CA 124.048 0.939 . . . . 0.0 111.632 177.216 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 19.7 mm-40 -66.85 -32.08 73.11 Favored 'General case' 0 N--CA 1.472 0.673 0 C-N-CA 123.158 0.583 . . . . 0.0 110.572 -176.2 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -63.32 -47.73 80.98 Favored 'General case' 0 C--O 1.238 0.465 0 CA-C-N 115.329 -0.851 . . . . 0.0 110.918 169.971 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 62.66 27.29 69.61 Favored Glycine 0 C--N 1.351 1.404 0 O-C-N 123.975 0.797 . . . . 0.0 111.332 -169.524 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 36.4 t -160.5 151.13 15.29 Favored Pre-proline 0 C--O 1.245 0.86 0 C-N-CA 124.478 1.111 . . . . 0.0 109.238 -166.155 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 15.4 Cg_endo -56.52 123.83 14.78 Favored 'Trans proline' 0 C--N 1.371 1.733 0 C-N-CA 122.738 2.292 . . . . 0.0 112.209 172.575 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 88.0 t -113.62 137.21 47.53 Favored 'Isoleucine or valine' 0 N--CA 1.47 0.544 0 C-N-CA 124.475 1.11 . . . . 0.0 108.61 179.334 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.434 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 95.1 mttt -75.1 148.56 39.62 Favored 'General case' 0 C--O 1.244 0.773 0 C-N-CA 123.221 0.608 . . . . 0.0 109.456 178.364 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.505 ' O ' HG23 ' A' ' 41' ' ' VAL . 45.6 tp -54.01 -43.09 69.77 Favored 'General case' 0 N--CA 1.469 0.525 0 O-C-N 124.544 1.152 . . . . 0.0 111.013 179.933 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -43.2 -51.06 6.25 Favored 'General case' 0 N--CA 1.48 1.042 0 C-N-CA 124.502 1.121 . . . . 0.0 113.184 170.57 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 49.8 tt0 -74.42 -30.91 62.11 Favored 'General case' 0 N--CA 1.472 0.631 0 C-N-CA 122.931 0.493 . . . . 0.0 110.84 -179.092 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.402 HD12 ' HA ' ' A' ' 37' ' ' LEU . 97.0 mt -61.83 -33.6 74.44 Favored 'General case' 0 N--CA 1.476 0.863 0 C-N-CA 122.897 0.479 . . . . 0.0 110.192 175.895 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.505 HG23 ' O ' ' A' ' 37' ' ' LEU . 60.9 t -59.38 -55.49 23.39 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.272 0 C-N-CA 123.609 0.764 . . . . 0.0 111.738 178.873 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 60.1 pttt -68.67 -41.98 78.52 Favored 'General case' 0 C--N 1.348 0.516 0 O-C-N 123.853 0.721 . . . . 0.0 111.003 -174.007 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 33.8 mm-40 -67.81 -48.17 67.03 Favored 'General case' 0 N--CA 1.472 0.633 0 C-N-CA 123.208 0.603 . . . . 0.0 112.03 -178.098 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 63.6 m -77.83 -13.67 59.81 Favored 'General case' 0 N--CA 1.476 0.853 0 C-N-CA 123.004 0.521 . . . . 0.0 111.325 -177.421 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 21.6 mm-40 57.69 40.57 26.39 Favored 'General case' 0 C--N 1.364 1.203 0 C-N-CA 124.253 1.021 . . . . 0.0 110.407 178.427 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.486 ' HB3' HD21 ' A' ' 51' ' ' LEU . . . -138.6 154.29 73.14 Favored Pre-proline 0 CA--C 1.553 1.075 0 CA-C-N 114.703 -1.135 . . . . 0.0 110.599 -172.509 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 34.1 Cg_exo -60.61 129.06 27.88 Favored 'Trans proline' 0 C--N 1.381 2.269 0 C-N-CA 123.198 2.598 . . . . 0.0 112.818 -178.839 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 39.5 ttmt -41.0 -48.82 3.27 Favored 'General case' 0 N--CA 1.481 1.117 0 C-N-CA 125.178 1.391 . . . . 0.0 114.08 171.465 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.462 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 82.1 mtm180 -59.24 -45.45 91.13 Favored 'General case' 0 N--CA 1.477 0.896 0 O-C-N 123.87 0.731 . . . . 0.0 111.061 179.109 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 3.0 tp10 -65.06 -46.28 81.83 Favored 'General case' 0 C--O 1.241 0.622 0 O-C-N 123.957 0.786 . . . . 0.0 109.661 -176.35 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.576 ' HA ' HD11 ' A' ' 20' ' ' LEU . 81.3 mt -56.1 -49.86 72.66 Favored 'General case' 0 C--N 1.356 0.874 0 CA-C-N 114.709 -1.132 . . . . 0.0 110.927 177.231 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.403 ' HA ' HD12 ' A' ' 55' ' ' LEU . 22.2 t-20 -63.15 -43.4 98.42 Favored 'General case' 0 C--N 1.353 0.757 0 O-C-N 124.385 1.053 . . . . 0.0 112.698 -173.997 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.462 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 78.8 mm-40 -60.97 -45.39 94.97 Favored 'General case' 0 N--CA 1.479 1.021 0 CA-C-O 120.573 0.225 . . . . 0.0 111.058 177.814 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . . . . . . . . . 91.5 t -66.17 -38.33 81.72 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.876 0 C-N-CA 123.341 0.656 . . . . 0.0 110.705 179.614 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.403 HD12 ' HA ' ' A' ' 52' ' ' ASN . 14.7 mt -53.1 -39.64 63.54 Favored 'General case' 0 N--CA 1.479 0.995 0 C-N-CA 124.684 1.193 . . . . 0.0 112.767 176.559 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 35.3 m-85 -68.03 -35.31 78.06 Favored 'General case' 0 C--O 1.244 0.769 0 CA-C-N 118.417 0.553 . . . . 0.0 112.033 179.129 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.492 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 66.1 ttp85 -68.01 -50.34 56.07 Favored 'General case' 0 C--N 1.358 0.968 0 N-CA-C 108.856 -0.794 . . . . 0.0 108.856 178.552 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.757 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 69.6 mtm -62.27 -28.39 69.68 Favored 'General case' 0 CA--C 1.539 0.527 0 O-C-N 123.989 0.806 . . . . 0.0 111.678 179.104 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 12.5 tmtt? -71.84 -38.91 70.06 Favored 'General case' 0 N--CA 1.474 0.759 0 N-CA-C 109.317 -0.623 . . . . 0.0 109.317 179.121 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 5.0 tppp? -63.44 -39.91 95.75 Favored 'General case' 0 CA--C 1.547 0.839 0 C-N-CA 123.304 0.642 . . . . 0.0 110.414 173.122 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.492 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.33 -2.54 45.8 Favored 'General case' 0 N--CA 1.482 1.146 0 C-N-CA 123.759 0.824 . . . . 0.0 111.436 178.861 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 95.1 mt 68.59 10.33 7.82 Favored 'General case' 0 N--CA 1.486 1.373 0 C-N-CA 125.155 1.382 . . . . 0.0 112.529 178.225 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.57 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 64.5 mttm -64.66 -32.02 73.5 Favored 'General case' 0 N--CA 1.478 0.96 0 C-N-CA 123.875 0.87 . . . . 0.0 110.416 174.724 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 18.5 m -130.62 165.37 31.1 Favored 'Isoleucine or valine' 0 C--O 1.245 0.834 0 C-N-CA 124.106 0.962 . . . . 0.0 109.115 172.678 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 17.2 t -143.44 145.13 32.36 Favored 'General case' 0 N--CA 1.467 0.412 0 N-CA-C 108.885 -0.783 . . . . 0.0 108.885 178.578 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 43.5 tp -95.7 103.88 15.78 Favored 'General case' 0 N--CA 1.473 0.708 0 C-N-CA 123.151 0.58 . . . . 0.0 109.546 -172.741 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 33.5 p -84.16 -45.62 12.77 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.572 0.749 . . . . 0.0 112.082 -174.205 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.477 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 17.8 m -132.29 169.43 13.91 Favored Pre-proline 0 N--CA 1.479 0.999 0 CA-C-O 117.44 -1.267 . . . . 0.0 107.587 179.053 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.425 ' HD2' ' HB3' ' A' ' 68' ' ' SER . 2.3 Cg_exo -29.09 -78.43 0.02 OUTLIER 'Trans proline' 0 C--N 1.394 2.945 0 C-N-CA 124.689 3.593 . . . . 0.0 115.266 178.529 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -100.18 19.52 16.31 Favored 'General case' 0 N--CA 1.486 1.358 0 CA-C-N 118.89 0.768 . . . . 0.0 112.026 177.8 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.477 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 20.6 m -107.97 125.85 52.01 Favored 'General case' 0 N--CA 1.479 0.984 0 CA-C-O 121.134 0.492 . . . . 0.0 109.859 -179.494 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 50.4 m95 -116.16 168.35 10.19 Favored 'General case' 0 N--CA 1.467 0.383 0 N-CA-C 107.976 -1.12 . . . . 0.0 107.976 -179.589 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.511 ' HA ' HD22 ' A' ' 28' ' ' LEU . 35.4 t -149.06 164.41 34.72 Favored 'General case' 0 N--CA 1.471 0.588 0 N-CA-C 109.821 -0.437 . . . . 0.0 109.821 176.885 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.618 ' HG ' ' H ' ' A' ' 76' ' ' GLY . 40.1 tp -65.98 143.82 57.14 Favored 'General case' 0 CA--C 1.539 0.521 0 O-C-N 123.529 0.518 . . . . 0.0 109.724 175.898 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -68.49 -18.4 71.69 Favored Glycine 0 C--N 1.344 0.993 0 O-C-N 123.649 0.593 . . . . 0.0 113.249 178.691 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.618 ' H ' ' HG ' ' A' ' 74' ' ' LEU . . . -78.88 -10.4 86.22 Favored Glycine 0 C--N 1.344 1.008 0 CA-C-O 119.62 -0.545 . . . . 0.0 114.115 175.544 . . . . . . . . 2 2 . 1 . 015 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 6.6 m -80.11 83.18 6.03 Favored 'General case' 0 CA--C 1.55 0.975 0 CA-C-O 121.258 0.551 . . . . 0.0 109.833 179.751 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 7.3 m-20 -90.86 131.04 38.55 Favored Pre-proline 0 N--CA 1.476 0.844 0 CA-C-N 115.486 -0.779 . . . . 0.0 110.469 179.367 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 72.2 Cg_endo -77.22 118.25 4.63 Favored 'Trans proline' 0 C--N 1.369 1.609 0 C-N-CA 122.436 2.09 . . . . 0.0 110.558 171.426 . . . . . . . . 1 1 . 1 . 015 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 38.7 tt0 . . . . . 0 CA--C 1.549 0.941 0 N-CA-C 108.911 -0.774 . . . . 0.0 108.911 175.23 . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 58.2 mtt . . . . . 0 N--CA 1.474 0.743 0 N-CA-C 109.069 -0.715 . . . . 0.0 109.069 . . . . . . . . . 0 0 . 1 . 016 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 71.55 -97.89 0.72 Allowed Glycine 0 C--N 1.349 1.279 0 CA-C-N 115.537 -0.756 . . . . 0.0 111.914 -175.315 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 18.6 m-70 -97.72 -42.39 7.64 Favored 'General case' 0 N--CA 1.476 0.848 0 N-CA-C 109.304 -0.628 . . . . 0.0 109.304 170.566 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 54.0 m80 -146.94 -73.62 0.21 Allowed 'General case' 0 N--CA 1.482 1.155 0 C-N-CA 123.863 0.865 . . . . 0.0 110.731 -176.831 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 47.1 t-80 -115.03 -21.76 9.88 Favored 'General case' 0 N--CA 1.492 1.65 0 C-N-CA 123.827 0.851 . . . . 0.0 112.633 -172.892 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 60.6 t-80 -71.35 99.31 1.93 Allowed 'General case' 0 N--CA 1.483 1.207 0 C-N-CA 123.416 0.686 . . . . 0.0 111.036 -174.43 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 8.5 p-80 -110.57 -173.77 2.32 Favored 'General case' 0 N--CA 1.489 1.475 0 C-N-CA 124.441 1.096 . . . . 0.0 111.887 -174.474 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 13.4 m170 -60.47 106.63 0.57 Allowed 'General case' 0 N--CA 1.483 1.221 0 C-N-CA 124.368 1.067 . . . . 0.0 110.213 173.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 34.9 t -129.12 88.62 2.74 Favored 'General case' 0 N--CA 1.474 0.765 0 C-N-CA 123.088 0.555 . . . . 0.0 110.484 -175.242 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 63.8 m80 -137.84 32.68 2.44 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 123.795 0.838 . . . . 0.0 109.946 -179.976 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 24.8 mmt 60.18 87.52 0.09 Allowed 'General case' 0 N--CA 1.488 1.468 0 C-N-CA 124.634 1.174 . . . . 0.0 108.753 -172.687 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . 64.35 -159.61 0.3 Allowed 'General case' 0 N--CA 1.484 1.268 0 C-N-CA 124.293 1.037 . . . . 0.0 109.349 -163.106 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 18.8 t70 -148.93 102.79 3.38 Favored Pre-proline 0 N--CA 1.471 0.606 0 N-CA-C 109.429 -0.582 . . . . 0.0 109.429 176.943 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 72.0 Cg_endo -102.32 111.99 0.05 OUTLIER 'Trans proline' 0 CA--C 1.561 1.843 0 C-N-CA 123.665 2.91 . . . . 0.0 112.443 165.755 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 159.32 -45.05 0.44 Allowed Glycine 0 C--N 1.349 1.289 0 N-CA-C 111.366 -0.693 . . . . 0.0 111.366 -178.801 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 0.8 OUTLIER -72.37 -33.18 67.04 Favored 'General case' 0 C--O 1.209 -1.041 0 CA-C-O 118.449 -0.786 . . . . 0.0 112.898 178.708 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 41.8 tt0 -66.59 -56.62 9.92 Favored 'General case' 0 N--CA 1.489 1.486 0 N-CA-C 113.402 0.889 . . . . 0.0 113.402 -160.494 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . 0.439 ' O ' ' HG3' ' A' ' 22' ' ' GLN . . . -66.3 -27.59 73.13 Favored Glycine 0 C--N 1.351 1.362 0 CA-C-O 120.145 -0.253 . . . . 0.0 113.315 177.127 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 12.2 m-70 -73.76 -35.15 64.97 Favored 'General case' 0 N--CA 1.479 0.992 0 C-N-CA 123.637 0.775 . . . . 0.0 109.163 177.448 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.5 HD12 HG21 ' A' ' 54' ' ' VAL . 2.8 tm? -66.88 -39.36 87.46 Favored 'General case' 0 N--CA 1.47 0.554 0 C-N-CA 125.784 1.634 . . . . 0.0 108.978 176.335 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 29.1 tt0 -66.71 -38.44 86.72 Favored 'General case' 0 CA--C 1.547 0.852 0 C-N-CA 123.965 0.906 . . . . 0.0 110.202 177.199 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . 0.439 ' HG3' ' O ' ' A' ' 18' ' ' GLY . 56.0 mt-30 -62.69 -40.19 96.33 Favored 'General case' 0 N--CA 1.484 1.236 0 C-N-CA 123.879 0.872 . . . . 0.0 110.455 174.228 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . . . . . . . . . 14.9 mmm180 -68.52 -42.87 77.9 Favored 'General case' 0 C--N 1.354 0.785 0 C-N-CA 123.614 0.766 . . . . 0.0 111.599 -179.229 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.446 HG13 ' O ' ' A' ' 20' ' ' LEU . 85.1 mt -58.89 -52.3 62.0 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.957 0 O-C-N 123.827 0.705 . . . . 0.0 109.361 177.926 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.643 HD21 ' HB3' ' A' ' 63' ' ' LYS . 91.5 mt -58.27 -40.47 81.95 Favored 'General case' 0 N--CA 1.479 1.007 0 C-N-CA 123.493 0.717 . . . . 0.0 111.367 -179.108 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 58.8 tt0 -67.48 -49.07 65.18 Favored 'General case' 0 N--CA 1.476 0.831 0 C-N-CA 123.468 0.707 . . . . 0.0 111.092 -177.294 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . . . . . . . . . 42.8 t -59.44 -39.49 79.29 Favored 'Isoleucine or valine' 0 CA--C 1.552 1.054 0 C-N-CA 124.534 1.134 . . . . 0.0 111.349 179.605 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.427 HD22 ' HA ' ' A' ' 73' ' ' CYS . 85.7 mt -67.89 -40.02 83.58 Favored 'General case' 0 CA--C 1.548 0.903 0 C-N-CA 123.875 0.87 . . . . 0.0 110.915 176.619 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.1 m -68.48 -48.83 63.46 Favored 'General case' 0 N--CA 1.477 0.919 0 C-N-CA 123.999 0.919 . . . . 0.0 111.426 -178.62 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 84.9 mt-10 -71.42 -39.51 71.03 Favored 'General case' 0 C--N 1.354 0.795 0 C-N-CA 123.182 0.593 . . . . 0.0 110.95 -173.469 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -62.6 -33.63 75.38 Favored 'General case' 0 N--CA 1.477 0.918 0 O-C-N 123.505 0.503 . . . . 0.0 111.059 173.585 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 64.36 32.52 84.47 Favored Glycine 0 C--N 1.354 1.542 0 O-C-N 123.959 0.787 . . . . 0.0 112.771 -178.988 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 17.4 p -170.31 155.86 5.31 Favored Pre-proline 0 CA--C 1.552 1.053 0 C-N-CA 124.192 0.997 . . . . 0.0 109.141 -171.348 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.561 ' HB3' ' HB2' ' A' ' 73' ' ' CYS . 20.2 Cg_endo -60.92 118.26 5.11 Favored 'Trans proline' 0 C--N 1.381 2.242 0 C-N-CA 122.728 2.285 . . . . 0.0 112.998 178.08 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 70.3 t -96.79 135.66 30.18 Favored 'Isoleucine or valine' 0 N--CA 1.473 0.708 0 N-CA-C 108.949 -0.76 . . . . 0.0 108.949 -179.835 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 90.3 mttt -66.11 143.75 57.12 Favored 'General case' 0 N--CA 1.47 0.552 0 C-N-CA 123.511 0.724 . . . . 0.0 109.986 178.691 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.51 HD13 HD11 ' A' ' 55' ' ' LEU . 13.1 tp -61.26 -41.77 97.49 Favored 'General case' 0 N--CA 1.477 0.886 0 C-N-CA 123.912 0.885 . . . . 0.0 110.67 179.053 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -45.5 -41.91 10.13 Favored 'General case' 0 N--CA 1.483 1.218 0 C-N-CA 124.094 0.957 . . . . 0.0 113.42 167.736 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.544 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 27.4 tt0 -82.89 -29.45 29.27 Favored 'General case' 0 N--CA 1.476 0.864 0 N-CA-C 109.973 -0.38 . . . . 0.0 109.973 -179.951 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 78.1 mt -60.05 -34.63 73.67 Favored 'General case' 0 N--CA 1.485 1.296 0 N-CA-C 109.805 -0.442 . . . . 0.0 109.805 176.683 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.423 ' HA ' HD11 ' A' ' 51' ' ' LEU . 91.5 t -51.8 -56.32 6.3 Favored 'Isoleucine or valine' 0 N--CA 1.491 1.585 0 C-N-CA 124.708 1.203 . . . . 0.0 111.701 175.206 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 14.7 ptmm? -71.53 -37.51 71.17 Favored 'General case' 0 N--CA 1.471 0.615 0 CA-C-N 116.151 -0.477 . . . . 0.0 111.181 -173.727 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.544 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 9.1 mm-40 -61.38 -53.11 60.8 Favored 'General case' 0 N--CA 1.479 0.996 0 C-N-CA 123.03 0.532 . . . . 0.0 111.704 179.463 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.528 ' SG ' ' HB3' ' A' ' 46' ' ' ALA . 30.4 p -83.93 -10.32 58.05 Favored 'General case' 0 CA--C 1.547 0.848 0 C-N-CA 123.113 0.565 . . . . 0.0 111.127 -176.33 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 51.9 mt-30 63.67 17.59 10.53 Favored 'General case' 0 N--CA 1.487 1.384 0 C-N-CA 124.623 1.169 . . . . 0.0 111.797 -178.87 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.528 ' HB3' ' SG ' ' A' ' 44' ' ' CYS . . . -107.98 151.84 41.45 Favored Pre-proline 0 N--CA 1.476 0.828 0 C-N-CA 124.134 0.974 . . . . 0.0 110.867 -175.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 28.9 Cg_endo -62.3 140.24 81.82 Favored 'Trans proline' 0 C--N 1.378 2.129 0 C-N-CA 122.548 2.165 . . . . 0.0 111.575 175.383 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 40.9 ttmt -47.1 -34.32 5.88 Favored 'General case' 0 C--O 1.213 -0.84 0 C-N-CA 124.19 0.996 . . . . 0.0 112.553 172.666 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . 0.44 ' O ' ' HG2' ' A' ' 53' ' ' GLN . 20.4 tpp180 -61.82 -47.38 85.33 Favored 'General case' 0 CA--C 1.554 1.116 0 C-N-CA 123.241 0.616 . . . . 0.0 111.779 177.303 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 32.3 tt0 -62.66 -47.31 84.26 Favored 'General case' 0 N--CA 1.492 1.668 0 C-N-CA 123.326 0.65 . . . . 0.0 110.249 178.637 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.492 ' HA ' HD11 ' A' ' 20' ' ' LEU . 17.3 mt -53.34 -56.46 16.53 Favored 'General case' 0 C--O 1.214 -0.786 0 C-N-CA 124.62 1.168 . . . . 0.0 110.893 176.151 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 23.9 t-20 -49.21 -52.53 26.31 Favored 'General case' 0 N--CA 1.48 1.057 0 C-N-CA 126.091 1.757 . . . . 0.0 111.868 -177.731 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . 0.44 ' HG2' ' O ' ' A' ' 49' ' ' ARG . 14.3 mm100 -53.42 -47.99 69.14 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.945 0.898 . . . . 0.0 111.667 177.783 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.5 HG21 HD12 ' A' ' 20' ' ' LEU . 85.1 t -68.32 -44.89 83.42 Favored 'Isoleucine or valine' 0 CA--C 1.556 1.175 0 CA-C-N 116.083 -0.508 . . . . 0.0 111.25 -179.07 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.51 HD11 HD13 ' A' ' 37' ' ' LEU . 54.6 mt -52.32 -44.51 65.14 Favored 'General case' 0 N--CA 1.485 1.28 0 C-N-CA 125.496 1.518 . . . . 0.0 114.306 -177.211 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 62.9 m-85 -62.89 -32.45 73.71 Favored 'General case' 0 N--CA 1.481 1.123 0 CA-C-N 118.202 0.456 . . . . 0.0 111.071 178.5 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.46 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 28.5 mmm-85 -70.68 -49.17 50.09 Favored 'General case' 0 C--N 1.347 0.497 0 C-N-CA 123.03 0.532 . . . . 0.0 109.768 177.352 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.475 ' HG3' ' O ' ' A' ' 54' ' ' VAL . 70.7 mtp -57.77 -36.12 71.69 Favored 'General case' 0 N--CA 1.485 1.306 0 C-N-CA 124.114 0.966 . . . . 0.0 111.618 -177.159 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 40.3 ttmt -59.4 -44.04 92.87 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 123.427 0.691 . . . . 0.0 110.246 176.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 93.7 mttt -75.29 -25.33 57.85 Favored 'General case' 0 N--CA 1.478 0.971 0 C-N-CA 124.502 1.121 . . . . 0.0 111.81 -179.531 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.46 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 7.0 mm-40 -77.83 -4.65 47.63 Favored 'General case' 0 CA--C 1.556 1.183 0 C-N-CA 123.041 0.536 . . . . 0.0 110.001 170.935 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . 0.54 ' HB3' ' HG3' ' A' ' 80' ' ' GLU . 83.1 mt 68.32 19.19 9.04 Favored 'General case' 0 C--N 1.368 1.394 0 C-N-CA 125.541 1.536 . . . . 0.0 111.438 178.45 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.643 ' HB3' HD21 ' A' ' 25' ' ' LEU . 98.8 mttt -80.72 -33.42 35.26 Favored 'General case' 0 C--N 1.345 0.391 0 C-N-CA 124.782 1.233 . . . . 0.0 111.711 -179.772 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 30.9 m -132.74 161.75 41.05 Favored 'Isoleucine or valine' 0 N--CA 1.484 1.259 0 CA-C-O 121.267 0.556 . . . . 0.0 111.189 -179.295 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 41.6 t -132.31 145.34 51.2 Favored 'General case' 0 CA--C 1.542 0.655 0 C-N-CA 124.904 1.281 . . . . 0.0 108.61 174.1 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 47.0 tp -95.67 109.01 21.35 Favored 'General case' 0 N--CA 1.48 1.048 0 N-CA-C 107.919 -1.141 . . . . 0.0 107.919 179.486 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 37.3 p -84.78 -44.57 13.19 Favored 'General case' 0 N--CA 1.475 0.814 0 C-N-CA 123.161 0.584 . . . . 0.0 111.168 -175.46 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.644 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 13.1 m -134.72 159.5 71.93 Favored Pre-proline 0 CA--C 1.555 1.141 0 CA-C-O 117.212 -1.375 . . . . 0.0 107.64 -175.852 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 10.1 Cg_exo -29.68 -66.02 0.07 OUTLIER 'Trans proline' 0 C--N 1.396 3.059 0 C-N-CA 125.017 3.811 . . . . 0.0 116.243 -174.547 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.65 40.07 3.02 Favored 'General case' 0 N--CA 1.483 1.201 0 C-N-CA 123.924 0.889 . . . . 0.0 111.084 177.089 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.644 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 91.1 m -131.2 122.82 27.23 Favored 'General case' 0 N--CA 1.478 0.932 0 C-N-CA 123.606 0.762 . . . . 0.0 109.869 177.102 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 69.5 m95 -114.25 151.47 32.79 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 124.119 0.968 . . . . 0.0 108.698 -172.829 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.561 ' HB2' ' HB3' ' A' ' 34' ' ' PRO . 42.7 t -132.54 170.26 15.41 Favored 'General case' 0 N--CA 1.476 0.845 0 C-N-CA 124.053 0.941 . . . . 0.0 109.209 177.904 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 25.0 tp -68.49 160.31 30.06 Favored 'General case' 0 CA--C 1.553 1.082 0 N-CA-C 108.857 -0.794 . . . . 0.0 108.857 170.712 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.418 ' HA3' ' HB3' ' A' ' 79' ' ' PRO . . . -57.27 -32.73 64.06 Favored Glycine 0 N--CA 1.476 1.313 0 C-N-CA 122.74 0.209 . . . . 0.0 112.722 179.512 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . 146.23 -171.55 27.08 Favored Glycine 0 C--N 1.346 1.138 0 C-N-CA 123.228 0.442 . . . . 0.0 112.076 173.39 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 3.8 t -66.01 102.37 0.79 Allowed 'General case' 0 CA--C 1.548 0.9 0 N-CA-C 108.612 -0.884 . . . . 0.0 108.612 170.927 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 24.9 t70 58.88 86.24 0.16 Allowed Pre-proline 0 N--CA 1.486 1.356 0 C-N-CA 124.294 1.038 . . . . 0.0 109.374 -166.148 . . . . . . . . 1 1 . 1 . 016 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . 0.418 ' HB3' ' HA3' ' A' ' 75' ' ' GLY . 37.8 Cg_exo -58.73 105.7 0.24 Allowed 'Trans proline' 0 C--N 1.385 2.478 0 C-N-CA 123.154 2.569 . . . . 0.0 113.248 -173.801 . . . . . . . . 2 2 . 1 . 016 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . 0.54 ' HG3' ' HB3' ' A' ' 62' ' ' LEU . 51.3 mm-40 . . . . . 0 CA--C 1.557 1.219 0 C-N-CA 125.051 1.34 . . . . 0.0 111.701 174.289 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 13.2 ptp . . . . . 0 N--CA 1.475 0.821 0 N-CA-C 109.541 -0.541 . . . . 0.0 109.541 . . . . . . . . . 0 0 . 1 . 017 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -172.41 26.31 0.09 OUTLIER Glycine 0 C--N 1.354 1.532 0 CA-C-N 115.483 -0.78 . . . . 0.0 112.156 -177.448 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 59.4 t-80 -131.18 60.53 1.66 Allowed 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 124.052 0.941 . . . . 0.0 109.153 177.967 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 7.2 p80 -159.81 100.72 1.45 Allowed 'General case' 0 N--CA 1.471 0.598 0 N-CA-C 108.268 -1.012 . . . . 0.0 108.268 171.951 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -62.83 96.27 0.09 Allowed 'General case' 0 CA--C 1.545 0.767 0 CA-C-O 121.264 0.554 . . . . 0.0 110.408 -179.327 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 33.7 p-80 -113.53 -21.61 10.74 Favored 'General case' 0 N--CA 1.477 0.897 0 C-N-CA 123.923 0.889 . . . . 0.0 110.209 -178.912 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 77.7 t60 -74.72 -65.81 0.82 Allowed 'General case' 0 CA--C 1.539 0.529 0 N-CA-C 108.783 -0.821 . . . . 0.0 108.783 172.93 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 30.3 p80 -93.73 97.09 10.21 Favored 'General case' 0 CA--C 1.546 0.817 0 CA-C-O 121.8 0.81 . . . . 0.0 109.43 173.469 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 19.0 t -165.33 9.37 0.03 OUTLIER 'General case' 0 N--CA 1.478 0.928 0 CA-C-N 115.098 -0.956 . . . . 0.0 110.5 179.311 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 42.7 m80 -127.71 -176.14 3.68 Favored 'General case' 0 N--CA 1.475 0.818 0 C-N-CA 124.274 1.03 . . . . 0.0 108.917 -174.707 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 0.0 OUTLIER -73.7 150.79 41.0 Favored 'General case' 0 C--O 1.242 0.698 0 C-N-CA 122.544 0.338 . . . . 0.0 110.454 175.212 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -74.51 -167.75 0.59 Allowed 'General case' 0 N--CA 1.479 1.021 0 C-N-CA 123.972 0.909 . . . . 0.0 110.181 173.985 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 17.7 m-20 -48.47 114.66 3.69 Favored Pre-proline 0 N--CA 1.483 1.178 0 N-CA-C 109.06 -0.719 . . . . 0.0 109.06 173.592 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 58.3 Cg_endo -67.35 -22.2 46.23 Favored 'Trans proline' 0 C--N 1.373 1.858 0 C-N-CA 122.839 2.36 . . . . 0.0 112.786 -164.675 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 117.73 106.41 2.36 Favored Glycine 0 C--N 1.348 1.2 0 N-CA-C 107.865 -2.094 . . . . 0.0 107.865 -173.194 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 56.3 mtt180 -68.44 -29.96 68.74 Favored 'General case' 0 N--CA 1.476 0.863 0 CA-C-N 117.391 0.595 . . . . 0.0 111.618 -169.45 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.7 tt0 -58.32 -49.64 76.46 Favored 'General case' 0 N--CA 1.478 0.934 0 C-N-CA 123.161 0.584 . . . . 0.0 109.784 171.248 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -68.72 -30.27 72.74 Favored Glycine 0 C--N 1.348 1.21 0 CA-C-N 114.643 -1.162 . . . . 0.0 113.458 179.279 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 10.8 t-80 -74.68 -39.1 62.2 Favored 'General case' 0 N--CA 1.48 1.036 0 N-CA-C 109.671 -0.492 . . . . 0.0 109.671 -179.293 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.475 HD12 HG21 ' A' ' 54' ' ' VAL . 2.4 tm? -65.11 -40.87 95.15 Favored 'General case' 0 N--CA 1.478 0.959 0 C-N-CA 124.444 1.098 . . . . 0.0 110.403 173.332 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.739 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 19.5 tt0 -58.28 -49.97 75.26 Favored 'General case' 0 N--CA 1.477 0.914 0 C-N-CA 125.313 1.445 . . . . 0.0 110.974 175.81 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 48.1 mt-30 -66.32 -31.6 72.49 Favored 'General case' 0 N--CA 1.472 0.631 0 CA-C-N 115.128 -0.942 . . . . 0.0 110.916 -179.067 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.422 ' O ' HG23 ' A' ' 27' ' ' VAL . 20.6 tpp180 -62.74 -47.15 84.82 Favored 'General case' 0 C--N 1.351 0.637 0 C-N-CA 122.944 0.498 . . . . 0.0 110.553 174.221 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.41 HG13 ' O ' ' A' ' 20' ' ' LEU . 68.6 mt -60.09 -46.94 93.72 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.949 0 O-C-N 123.859 0.725 . . . . 0.0 109.9 -179.771 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.487 HD11 ' HD3' ' A' ' 63' ' ' LYS . 93.2 mt -62.16 -35.89 80.17 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.547 0.739 . . . . 0.0 110.97 -178.559 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . 0.511 ' O ' ' HG2' ' A' ' 30' ' ' GLU . 29.8 tt0 -70.28 -44.66 67.94 Favored 'General case' 0 N--CA 1.476 0.848 0 O-C-N 123.885 0.741 . . . . 0.0 110.567 178.734 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.422 HG23 ' O ' ' A' ' 23' ' ' ARG . 55.8 t -54.23 -44.59 65.46 Favored 'Isoleucine or valine' 0 N--CA 1.486 1.356 0 C-N-CA 123.979 0.912 . . . . 0.0 110.938 174.834 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . . . . . . . . . 91.9 mt -66.26 -37.45 85.51 Favored 'General case' 0 CA--C 1.548 0.882 0 CA-C-N 114.816 -1.084 . . . . 0.0 110.577 179.057 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 65.3 m -64.22 -51.16 65.01 Favored 'General case' 0 N--CA 1.476 0.865 0 C-N-CA 124.167 0.987 . . . . 0.0 111.605 177.786 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . 0.511 ' HG2' ' O ' ' A' ' 26' ' ' GLN . 15.7 mm-40 -63.29 -46.6 86.0 Favored 'General case' 0 N--CA 1.476 0.869 0 C-N-CA 123.223 0.609 . . . . 0.0 111.444 -173.523 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -64.95 -38.29 90.46 Favored 'General case' 0 C--O 1.24 0.578 0 O-C-N 124.177 0.923 . . . . 0.0 110.573 178.257 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 81.57 -56.8 4.91 Favored Glycine 0 C--N 1.351 1.368 0 CA-C-N 115.929 -0.578 . . . . 0.0 112.142 178.964 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 75.1 p -72.58 161.92 76.72 Favored Pre-proline 0 CA--C 1.555 1.145 0 C-N-CA 124.12 0.968 . . . . 0.0 110.835 173.661 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 85.0 Cg_exo -50.41 142.59 29.5 Favored 'Trans proline' 0 C--N 1.377 2.077 0 C-N-CA 122.982 2.455 . . . . 0.0 113.368 172.442 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 39.6 t -121.79 132.1 71.6 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.994 0 C-N-CA 123.731 0.812 . . . . 0.0 109.426 -177.48 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 51.5 mtmt -69.96 148.42 48.94 Favored 'General case' 0 CA--C 1.537 0.459 0 C-N-CA 123.04 0.536 . . . . 0.0 109.806 176.506 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.408 ' HG ' ' HG3' ' A' ' 48' ' ' LYS . 38.7 tp -60.78 -45.26 95.05 Favored 'General case' 0 N--CA 1.474 0.746 0 C-N-CA 124.679 1.192 . . . . 0.0 110.494 -179.12 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -48.63 -37.66 18.82 Favored 'General case' 0 N--CA 1.481 1.096 0 C-N-CA 124.334 1.054 . . . . 0.0 113.509 168.413 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 48.2 tt0 -82.48 -28.84 30.94 Favored 'General case' 0 N--CA 1.48 1.033 0 C-N-CA 122.64 0.376 . . . . 0.0 110.908 178.281 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.406 HD12 ' HA ' ' A' ' 37' ' ' LEU . 94.3 mt -60.55 -32.36 71.43 Favored 'General case' 0 CA--C 1.548 0.888 0 C-N-CA 122.458 0.303 . . . . 0.0 110.219 174.314 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.4 HG23 ' O ' ' A' ' 37' ' ' LEU . 27.8 t -56.59 -56.21 15.23 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.437 0 C-N-CA 123.945 0.898 . . . . 0.0 111.789 176.869 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 21.5 ptmt -64.22 -47.08 81.08 Favored 'General case' 0 N--CA 1.479 1.015 0 O-C-N 123.591 0.557 . . . . 0.0 110.961 -177.319 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 18.8 mm-40 -61.74 -48.11 82.17 Favored 'General case' 0 N--CA 1.474 0.755 0 C-N-CA 123.453 0.701 . . . . 0.0 112.788 -178.243 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 64.4 m -82.67 -12.29 57.73 Favored 'General case' 0 CA--C 1.543 0.68 0 C-N-CA 122.663 0.385 . . . . 0.0 111.971 -176.885 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 20.4 mm-40 57.23 31.4 20.0 Favored 'General case' 0 N--CA 1.488 1.45 0 C-N-CA 123.779 0.832 . . . . 0.0 111.866 -179.251 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . 0.424 ' HB3' HD21 ' A' ' 51' ' ' LEU . . . -125.14 154.61 71.68 Favored Pre-proline 0 N--CA 1.469 0.523 0 CA-C-N 114.928 -1.033 . . . . 0.0 109.727 -174.974 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . 0.462 ' HG2' ' HB2' ' A' ' 50' ' ' GLU . 31.1 Cg_endo -62.22 132.31 38.28 Favored 'Trans proline' 0 C--N 1.377 2.075 0 C-N-CA 121.851 1.701 . . . . 0.0 110.961 175.977 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.408 ' HG3' ' HG ' ' A' ' 37' ' ' LEU . 40.5 ttmt -40.01 -43.99 1.66 Allowed 'General case' 0 N--CA 1.482 1.14 0 C-N-CA 124.976 1.31 . . . . 0.0 113.42 174.722 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 51.4 ttp180 -58.48 -42.3 87.2 Favored 'General case' 0 CA--C 1.551 0.981 0 C-N-CA 124.182 0.993 . . . . 0.0 112.125 -179.577 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . 0.462 ' HB2' ' HG2' ' A' ' 47' ' ' PRO . 10.0 tp10 -64.64 -50.18 68.12 Favored 'General case' 0 N--CA 1.481 1.085 0 C-N-CA 123.698 0.799 . . . . 0.0 109.831 179.674 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.424 HD21 ' HB3' ' A' ' 46' ' ' ALA . 51.8 mt -59.42 -54.62 44.59 Favored 'General case' 0 N--CA 1.478 0.961 0 C-N-CA 124.211 1.005 . . . . 0.0 111.503 -178.922 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . 0.51 ' HA ' HD12 ' A' ' 55' ' ' LEU . 58.2 t30 -50.87 -51.2 53.91 Favored 'General case' 0 N--CA 1.477 0.889 0 C-N-CA 126.282 1.833 . . . . 0.0 112.072 -177.241 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 64.4 tt0 -62.6 -43.55 98.52 Favored 'General case' 0 CA--C 1.545 0.787 0 O-C-N 123.729 0.643 . . . . 0.0 111.332 -179.658 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.475 HG21 HD12 ' A' ' 20' ' ' LEU . 83.1 t -65.54 -35.61 75.68 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.076 0 N-CA-C 110.185 -0.302 . . . . 0.0 110.185 179.108 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.51 HD12 ' HA ' ' A' ' 52' ' ' ASN . 30.9 mt -56.94 -37.54 71.66 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.105 0.962 . . . . 0.0 112.82 176.39 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 69.9 m-85 -70.03 -33.43 71.97 Favored 'General case' 0 N--CA 1.474 0.733 0 CA-C-N 118.766 0.712 . . . . 0.0 111.085 178.437 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 44.6 ttt180 -70.72 -48.25 55.57 Favored 'General case' 0 CA--C 1.543 0.711 0 N-CA-C 109.555 -0.535 . . . . 0.0 109.555 178.916 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.739 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 74.9 mtm -64.4 -29.11 70.18 Favored 'General case' 0 N--CA 1.47 0.573 0 C-N-CA 123.857 0.863 . . . . 0.0 111.679 178.135 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 86.2 tttt -63.45 -40.98 98.6 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.053 0.541 . . . . 0.0 110.562 175.333 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 37.5 ttpt -71.46 -25.3 62.23 Favored 'General case' 0 CA--C 1.549 0.909 0 C-N-CA 123.283 0.633 . . . . 0.0 111.135 176.165 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 17.6 mm-40 -85.0 -2.53 58.07 Favored 'General case' 0 N--CA 1.484 1.25 0 C-N-CA 123.283 0.633 . . . . 0.0 111.647 172.19 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.0 mm? 66.58 17.1 10.57 Favored 'General case' 0 N--CA 1.491 1.597 0 C-N-CA 124.922 1.289 . . . . 0.0 112.469 178.636 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.552 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 96.6 mttt -73.2 -38.61 66.05 Favored 'General case' 0 N--CA 1.473 0.703 0 C-N-CA 124.043 0.937 . . . . 0.0 110.99 175.711 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.438 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 18.6 m -127.1 164.41 27.86 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.06 0 C-N-CA 123.451 0.7 . . . . 0.0 110.14 179.333 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 48.5 m -144.91 151.66 39.03 Favored 'General case' 0 N--CA 1.47 0.529 0 N-CA-C 108.774 -0.825 . . . . 0.0 108.774 176.334 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 31.0 tp -96.03 101.61 13.29 Favored 'General case' 0 CA--C 1.545 0.78 0 N-CA-C 107.625 -1.25 . . . . 0.0 107.625 -178.696 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.6 p -84.69 -41.78 15.93 Favored 'General case' 0 N--CA 1.479 1.02 0 C-N-CA 123.544 0.738 . . . . 0.0 111.557 -173.597 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.435 ' HB2' ' HB ' ' A' ' 71' ' ' THR . 49.1 m -134.93 167.77 21.12 Favored Pre-proline 0 N--CA 1.481 1.124 0 C-N-CA 123.751 0.82 . . . . 0.0 109.64 178.47 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 82.1 Cg_exo -49.98 110.78 0.41 Allowed 'Trans proline' 0 C--N 1.388 2.617 0 C-N-CA 122.976 2.451 . . . . 0.0 112.867 174.816 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 61.8 33.73 17.6 Favored 'General case' 0 N--CA 1.482 1.162 0 C-N-CA 124.982 1.313 . . . . 0.0 111.56 -178.082 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.435 ' HB ' ' HB2' ' A' ' 68' ' ' SER . 51.0 m -129.67 121.76 27.62 Favored 'General case' 0 C--O 1.238 0.462 0 N-CA-C 108.614 -0.884 . . . . 0.0 108.614 178.756 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 74.0 m95 -118.45 142.47 47.53 Favored 'General case' 0 N--CA 1.465 0.317 0 C-N-CA 124.275 1.03 . . . . 0.0 108.315 -174.12 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 33.7 t -130.4 165.74 21.94 Favored 'General case' 0 C--O 1.239 0.54 0 N-CA-C 108.822 -0.807 . . . . 0.0 108.822 -179.39 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.647 HD11 ' HB ' ' A' ' 77' ' ' THR . 30.2 tp -74.61 102.53 4.6 Favored 'General case' 0 C--O 1.24 0.584 0 N-CA-C 108.854 -0.795 . . . . 0.0 108.854 -179.0 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.438 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . -74.47 -36.9 48.24 Favored Glycine 0 C--N 1.34 0.794 0 O-C-N 123.896 0.748 . . . . 0.0 111.524 -178.313 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . 0.443 ' O ' ' HA ' ' A' ' 63' ' ' LYS . . . 168.16 98.51 0.12 Allowed Glycine 0 C--N 1.339 0.74 0 N-CA-C 111.537 -0.625 . . . . 0.0 111.537 176.565 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.647 ' HB ' HD11 ' A' ' 74' ' ' LEU . 6.8 t -73.9 90.9 1.95 Allowed 'General case' 0 CA--C 1.553 1.084 0 CA-C-O 122.075 0.94 . . . . 0.0 109.666 176.651 . . . . . . . . 2 2 . 1 . 017 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 6.3 p-10 -71.12 165.08 51.28 Favored Pre-proline 0 CA--C 1.551 1.0 0 CA-C-N 115.122 -0.944 . . . . 0.0 109.913 176.702 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 32.4 Cg_exo -37.73 107.37 0.05 OUTLIER 'Trans proline' 0 C--N 1.388 2.607 0 C-N-CA 123.657 2.905 . . . . 0.0 113.985 175.552 . . . . . . . . 1 1 . 1 . 017 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 11.3 tp10 . . . . . 0 C--O 1.248 1.015 0 CA-C-N 115.525 -0.761 . . . . 0.0 109.972 -173.458 . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 20.4 ptp . . . . . 0 N--CA 1.481 1.123 0 N-CA-C 111.218 0.081 . . . . 0.0 111.218 . . . . . . . . . 0 0 . 1 . 018 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . 80.31 164.53 30.6 Favored Glycine 0 C--N 1.36 1.884 0 O-C-N 123.297 0.373 . . . . 0.0 112.41 -175.682 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 41.0 t-80 -70.93 -32.95 70.02 Favored 'General case' 0 N--CA 1.478 0.95 0 N-CA-C 108.717 -0.846 . . . . 0.0 108.717 170.041 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 31.1 m-70 -77.72 109.95 12.16 Favored 'General case' 0 CA--C 1.54 0.561 0 N-CA-C 108.204 -1.036 . . . . 0.0 108.204 166.625 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 38.6 t-80 -72.27 -43.52 64.15 Favored 'General case' 0 N--CA 1.476 0.865 0 CA-C-O 120.959 0.409 . . . . 0.0 110.246 -177.886 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.3 m80 -77.06 137.98 39.28 Favored 'General case' 0 CA--C 1.537 0.473 0 CA-C-N 115.167 -0.924 . . . . 0.0 108.908 170.638 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 7.9 p80 -92.72 42.64 1.11 Allowed 'General case' 0 N--CA 1.481 1.076 0 N-CA-C 112.239 0.459 . . . . 0.0 112.239 -172.502 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 73.3 t60 -70.77 -30.91 67.53 Favored 'General case' 0 N--CA 1.49 1.564 0 CA-C-O 121.191 0.52 . . . . 0.0 109.967 171.358 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 8.7 p -62.14 91.98 0.04 OUTLIER 'General case' 0 CA--C 1.547 0.843 0 CA-C-N 114.817 -1.083 . . . . 0.0 111.213 179.965 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 33.8 p-80 -68.67 128.02 35.15 Favored 'General case' 0 N--CA 1.479 1.003 0 CA-C-N 115.415 -0.811 . . . . 0.0 110.16 178.398 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 19.1 ptp 38.42 65.29 0.63 Allowed 'General case' 0 N--CA 1.49 1.546 0 C-N-CA 125.253 1.421 . . . . 0.0 111.459 -173.168 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -56.92 87.41 0.01 OUTLIER 'General case' 0 C--N 1.351 0.65 0 CA-C-N 114.721 -1.127 . . . . 0.0 111.681 -171.854 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 30.7 t70 -67.67 125.54 91.4 Favored Pre-proline 0 CA--C 1.532 0.273 0 C-N-CA 124.27 1.028 . . . . 0.0 109.632 179.615 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 19.4 Cg_endo -56.79 148.64 64.94 Favored 'Trans proline' 0 C--N 1.374 1.877 0 C-N-CA 122.4 2.067 . . . . 0.0 110.845 179.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -132.71 108.52 0.77 Allowed Glycine 0 C--N 1.338 0.64 0 N-CA-C 108.122 -1.991 . . . . 0.0 108.122 -172.518 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 97.1 mtt180 -60.91 -42.3 97.78 Favored 'General case' 0 C--O 1.211 -0.948 0 C-N-CA 123.261 0.625 . . . . 0.0 112.421 -167.67 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 29.1 mt-10 -61.15 -57.72 11.33 Favored 'General case' 0 N--CA 1.483 1.19 0 C-N-CA 122.916 0.486 . . . . 0.0 111.027 -176.488 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.9 -44.2 89.55 Favored Glycine 0 C--N 1.349 1.26 0 O-C-N 124.045 0.841 . . . . 0.0 114.762 -178.201 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 21.5 m80 -70.67 -39.6 73.48 Favored 'General case' 0 N--CA 1.49 1.538 0 CA-C-N 117.929 0.864 . . . . 0.0 110.972 -175.373 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.445 ' O ' HG13 ' A' ' 24' ' ' ILE . 2.4 tm? -64.98 -40.29 94.75 Favored 'General case' 0 CA--C 1.546 0.827 0 C-N-CA 123.348 0.659 . . . . 0.0 110.1 174.788 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 24.5 tt0 -58.66 -47.76 83.37 Favored 'General case' 0 N--CA 1.478 0.974 0 C-N-CA 124.295 1.038 . . . . 0.0 111.395 174.004 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 0.9 OUTLIER -61.98 -36.88 82.8 Favored 'General case' 0 N--CA 1.469 0.475 0 CA-C-N 115.67 -0.695 . . . . 0.0 110.039 179.037 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.427 ' O ' HG23 ' A' ' 27' ' ' VAL . 16.4 tpt180 -67.41 -41.63 84.56 Favored 'General case' 0 CA--C 1.549 0.907 0 C-N-CA 123.083 0.553 . . . . 0.0 111.011 178.209 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.474 HG21 HD21 ' A' ' 55' ' ' LEU . 79.4 mt -60.28 -52.93 55.54 Favored 'Isoleucine or valine' 0 N--CA 1.479 1.011 0 C-N-CA 122.836 0.454 . . . . 0.0 110.432 176.369 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . . . . . . . . . 89.6 mt -61.18 -32.68 72.42 Favored 'General case' 0 N--CA 1.479 1.013 0 C-N-CA 123.503 0.721 . . . . 0.0 111.09 -178.458 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 7.5 tt0 -63.55 -52.13 62.41 Favored 'General case' 0 CA--C 1.543 0.71 0 C-N-CA 124.354 1.061 . . . . 0.0 109.926 176.993 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.427 HG23 ' O ' ' A' ' 23' ' ' ARG . 76.1 t -58.2 -41.86 81.93 Favored 'Isoleucine or valine' 0 N--CA 1.48 1.046 0 C-N-CA 123.966 0.906 . . . . 0.0 110.591 178.447 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.479 ' HB3' ' HB2' ' A' ' 74' ' ' LEU . 97.5 mt -69.88 -36.0 75.1 Favored 'General case' 0 N--CA 1.475 0.779 0 C-N-CA 123.302 0.641 . . . . 0.0 111.695 -177.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 86.4 m -70.44 -45.04 66.61 Favored 'General case' 0 N--CA 1.479 1.003 0 C-N-CA 123.359 0.663 . . . . 0.0 111.861 177.709 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 49.6 mt-10 -71.81 -33.42 68.52 Favored 'General case' 0 N--CA 1.477 0.876 0 C-N-CA 122.948 0.499 . . . . 0.0 111.326 -175.851 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -71.79 -40.79 68.98 Favored 'General case' 0 N--CA 1.471 0.575 0 N-CA-C 109.808 -0.442 . . . . 0.0 109.808 168.822 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 61.84 26.53 67.2 Favored Glycine 0 C--N 1.349 1.257 0 CA-C-N 115.393 -0.821 . . . . 0.0 112.643 -175.689 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.1 t -152.53 150.6 25.3 Favored Pre-proline 0 CA--C 1.545 0.767 0 C-N-CA 124.262 1.025 . . . . 0.0 109.028 -171.307 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 77.8 Cg_exo -51.19 125.11 15.49 Favored 'Trans proline' 0 C--N 1.373 1.857 0 C-N-CA 122.675 2.25 . . . . 0.0 113.32 173.185 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 58.9 t -115.94 132.8 64.36 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.897 0 C-N-CA 124.143 0.977 . . . . 0.0 108.521 -179.555 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . 0.511 ' HA ' ' HA ' ' A' ' 71' ' ' THR . 54.7 mtpt -64.35 151.7 43.24 Favored 'General case' 0 N--CA 1.479 1.017 0 C-N-CA 123.492 0.717 . . . . 0.0 111.19 178.185 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.416 ' O ' HG23 ' A' ' 41' ' ' VAL . 51.9 tp -62.4 -50.51 71.26 Favored 'General case' 0 C--N 1.356 0.855 0 O-C-N 123.424 0.452 . . . . 0.0 109.852 176.382 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -47.03 -37.95 10.17 Favored 'General case' 0 N--CA 1.481 1.078 0 C-N-CA 123.99 0.916 . . . . 0.0 112.848 170.919 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . 0.407 ' O ' ' HG2' ' A' ' 43' ' ' GLU . 61.6 tt0 -78.31 -34.66 48.57 Favored 'General case' 0 N--CA 1.473 0.718 0 C-N-CA 123.253 0.621 . . . . 0.0 110.619 -179.475 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 66.9 mt -62.66 -30.4 71.35 Favored 'General case' 0 N--CA 1.477 0.92 0 C-N-CA 123.601 0.761 . . . . 0.0 110.815 177.383 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.416 HG23 ' O ' ' A' ' 37' ' ' LEU . 35.8 t -55.49 -50.88 63.03 Favored 'Isoleucine or valine' 0 N--CA 1.485 1.278 0 C-N-CA 123.37 0.668 . . . . 0.0 111.706 177.919 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 19.5 ptpt -76.26 -43.62 41.05 Favored 'General case' 0 CA--C 1.545 0.783 0 CA-C-O 119.112 -0.47 . . . . 0.0 111.986 -179.983 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . 0.407 ' HG2' ' O ' ' A' ' 39' ' ' GLN . 24.8 mm-40 -59.59 -56.51 20.96 Favored 'General case' 0 N--CA 1.485 1.279 0 CA-C-N 118.274 0.488 . . . . 0.0 112.039 -179.605 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 62.7 m -72.74 -8.39 55.16 Favored 'General case' 0 CA--C 1.543 0.675 0 C-N-CA 122.827 0.451 . . . . 0.0 111.632 -177.807 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 53.3 mt-30 61.9 22.87 13.37 Favored 'General case' 0 C--N 1.369 1.454 0 C-N-CA 124.615 1.166 . . . . 0.0 111.017 -177.858 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -123.84 149.01 58.35 Favored Pre-proline 0 C--O 1.235 0.342 0 CA-C-N 114.929 -1.032 . . . . 0.0 110.92 -164.417 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 41.8 Cg_endo -67.47 133.14 29.2 Favored 'Trans proline' 0 C--N 1.364 1.375 0 C-N-CA 122.508 2.139 . . . . 0.0 111.761 -177.955 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 53.7 tttm -42.15 -36.14 1.11 Allowed 'General case' 0 N--CA 1.476 0.851 0 C-N-CA 125.734 1.613 . . . . 0.0 112.934 173.637 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 34.9 ttm105 -54.6 -56.62 17.09 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 124.355 1.062 . . . . 0.0 112.21 176.222 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 0.7 OUTLIER -67.01 -44.75 79.53 Favored 'General case' 0 N--CA 1.475 0.792 0 CA-C-N 114.964 -1.016 . . . . 0.0 110.873 -176.787 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . . . . . . . . . 64.7 mt -55.37 -59.71 4.43 Favored 'General case' 0 C--O 1.212 -0.881 0 O-C-N 124.082 0.864 . . . . 0.0 111.093 176.695 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 26.0 t-20 -48.4 -56.12 9.01 Favored 'General case' 0 N--CA 1.483 1.223 0 C-N-CA 125.278 1.431 . . . . 0.0 112.089 -179.584 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 34.7 tt0 -57.33 -52.61 64.63 Favored 'General case' 0 CA--C 1.546 0.813 0 C-N-CA 123.779 0.832 . . . . 0.0 112.101 -177.441 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.544 HG12 ' SD ' ' A' ' 58' ' ' MET . 97.4 t -67.05 -38.0 80.43 Favored 'Isoleucine or valine' 0 CA--C 1.549 0.912 0 C-N-CA 122.821 0.448 . . . . 0.0 110.204 -177.114 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.474 HD21 HG21 ' A' ' 24' ' ' ILE . 17.4 mt -54.06 -40.38 67.1 Favored 'General case' 0 N--CA 1.484 1.232 0 C-N-CA 124.685 1.194 . . . . 0.0 114.137 177.693 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 74.0 m-85 -71.76 -24.32 61.74 Favored 'General case' 0 N--CA 1.483 1.188 0 CA-C-N 119.436 1.016 . . . . 0.0 111.365 178.402 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 55.1 ttp180 -73.61 -48.82 29.76 Favored 'General case' 0 C--N 1.349 0.582 0 N-CA-C 109.09 -0.708 . . . . 0.0 109.09 173.672 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.544 ' SD ' HG12 ' A' ' 54' ' ' VAL . 66.0 mtp -60.68 -37.74 82.64 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 124.603 1.161 . . . . 0.0 111.476 179.3 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 58.6 tttm -58.51 -45.97 87.69 Favored 'General case' 0 N--CA 1.469 0.51 0 C-N-CA 124.424 1.09 . . . . 0.0 110.599 175.397 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . 0.43 ' HB2' ' NZ ' ' A' ' 60' ' ' LYS . 4.3 ttmp? -72.77 -26.45 61.54 Favored 'General case' 0 CA--C 1.552 1.046 0 CA-C-N 114.652 -1.158 . . . . 0.0 111.096 -179.907 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 67.0 mm-40 -85.52 -2.17 57.86 Favored 'General case' 0 N--CA 1.482 1.161 0 C-N-CA 123.831 0.852 . . . . 0.0 111.265 174.551 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 3.5 mm? 69.95 12.17 7.81 Favored 'General case' 0 N--CA 1.49 1.544 0 C-N-CA 124.978 1.311 . . . . 0.0 112.306 179.943 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.415 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 94.4 mttt -70.03 -37.13 75.5 Favored 'General case' 0 N--CA 1.479 0.989 0 C-N-CA 123.726 0.81 . . . . 0.0 110.792 175.272 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . . . . . . . . . 22.2 m -131.25 175.77 10.44 Favored 'Isoleucine or valine' 0 N--CA 1.476 0.865 0 N-CA-C 109.039 -0.726 . . . . 0.0 109.039 173.734 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.3 t -144.13 158.13 43.9 Favored 'General case' 0 C--O 1.238 0.451 0 N-CA-C 107.412 -1.329 . . . . 0.0 107.412 178.497 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 30.5 tp -109.56 113.16 25.72 Favored 'General case' 0 CA--C 1.537 0.477 0 N-CA-C 107.804 -1.184 . . . . 0.0 107.804 175.764 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 21.6 p -100.47 -31.95 11.04 Favored 'General case' 0 N--CA 1.478 0.949 0 C-N-CA 123.572 0.749 . . . . 0.0 111.283 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.684 ' HB3' ' HB ' ' A' ' 71' ' ' THR . 39.2 t -139.23 148.37 56.82 Favored Pre-proline 0 CA--C 1.552 1.035 0 N-CA-C 107.069 -1.456 . . . . 0.0 107.069 -179.558 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 4.7 Cg_exo -26.0 -72.76 0.03 OUTLIER 'Trans proline' 0 C--N 1.39 2.739 1 C-N-CA 125.407 4.071 . . . . 0.0 116.721 -172.39 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -111.84 39.34 2.4 Favored 'General case' 0 CA--C 1.55 0.96 0 C-N-CA 123.345 0.658 . . . . 0.0 111.008 177.013 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.684 ' HB ' ' HB3' ' A' ' 68' ' ' SER . 86.2 m -131.27 123.02 27.48 Favored 'General case' 0 N--CA 1.475 0.784 0 C-N-CA 123.801 0.84 . . . . 0.0 109.239 176.535 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 86.0 m95 -104.51 160.34 15.01 Favored 'General case' 0 C--O 1.223 -0.297 0 CA-C-N 115.231 -0.895 . . . . 0.0 109.622 -173.133 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 51.8 t -138.63 156.17 47.67 Favored 'General case' 0 C--N 1.323 -0.553 0 N-CA-C 108.393 -0.966 . . . . 0.0 108.393 -179.801 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . 0.504 HD21 ' HB ' ' A' ' 77' ' ' THR . 35.7 tp -76.21 131.03 39.07 Favored 'General case' 0 CA--C 1.542 0.665 0 C-N-CA 122.77 0.428 . . . . 0.0 110.393 177.885 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . . . . . . . . . . . -108.35 -55.94 0.58 Allowed Glycine 0 C--N 1.343 0.924 0 N-CA-C 111.908 -0.477 . . . . 0.0 111.908 178.377 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -138.89 102.88 0.37 Allowed Glycine 0 C--N 1.335 0.49 0 N-CA-C 110.757 -0.937 . . . . 0.0 110.757 -176.667 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . 0.504 ' HB ' HD21 ' A' ' 74' ' ' LEU . 11.4 t -100.96 172.6 6.93 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 123.553 0.741 . . . . 0.0 110.628 179.992 . . . . . . . . 2 2 . 1 . 018 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 10.2 p-10 -158.16 58.4 1.38 Allowed Pre-proline 0 CA--C 1.561 1.393 0 C-N-CA 123.583 0.753 . . . . 0.0 110.186 179.219 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 39.4 Cg_endo -88.56 -156.84 0.06 OUTLIER 'Trans proline' 0 C--N 1.378 2.104 0 C-N-CA 123.0 2.466 . . . . 0.0 112.331 -174.479 . . . . . . . . 1 1 . 1 . 018 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 8.8 pt-20 . . . . . 0 C--O 1.249 1.077 0 C-N-CA 123.479 0.712 . . . . 0.0 110.072 -179.259 . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 25.3 ttt . . . . . 0 N--CA 1.487 1.379 0 CA-C-O 120.32 0.105 . . . . 0.0 111.014 . . . . . . . . . 0 0 . 1 . 019 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -67.78 -5.19 37.27 Favored Glycine 0 C--N 1.348 1.248 0 N-CA-C 116.14 1.216 . . . . 0.0 116.14 -171.378 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 4.9 p80 -63.47 -33.31 75.29 Favored 'General case' 0 N--CA 1.481 1.097 0 CA-C-N 117.922 0.861 . . . . 0.0 110.532 173.399 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 85.0 t60 -81.21 76.71 8.14 Favored 'General case' 0 CA--C 1.545 0.758 0 CA-C-N 115.893 -0.594 . . . . 0.0 109.967 177.7 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 21.0 m170 -149.59 156.19 41.53 Favored 'General case' 0 N--CA 1.477 0.906 0 C-N-CA 124.82 1.248 . . . . 0.0 108.667 176.687 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 32.1 p80 -79.27 87.27 4.97 Favored 'General case' 0 CA--C 1.55 0.977 0 CA-C-O 121.598 0.713 . . . . 0.0 109.923 177.469 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 69.4 m-70 -81.3 -41.53 21.98 Favored 'General case' 0 N--CA 1.482 1.134 0 N-CA-C 109.08 -0.711 . . . . 0.0 109.08 179.506 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 36.8 m80 -122.66 107.84 12.41 Favored 'General case' 0 N--CA 1.471 0.599 0 C-N-CA 124.084 0.954 . . . . 0.0 108.44 177.594 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . 0.403 ' H ' ' H ' ' A' ' 10' ' ' HIS . 30.9 t -174.55 -8.74 0.01 OUTLIER 'General case' 0 N--CA 1.48 1.062 0 C-N-CA 123.509 0.724 . . . . 0.0 111.758 -177.591 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . 0.403 ' H ' ' H ' ' A' ' 9' ' ' SER . 58.3 t-80 64.73 78.29 0.29 Allowed 'General case' 0 N--CA 1.483 1.188 0 C-N-CA 124.824 1.25 . . . . 0.0 111.066 -179.84 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 26.4 ptt? -62.58 115.08 3.96 Favored 'General case' 0 CA--C 1.551 0.992 0 CA-C-N 115.47 -0.786 . . . . 0.0 110.381 178.726 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -156.36 35.86 0.33 Allowed 'General case' 0 N--CA 1.473 0.711 0 CA-C-O 121.792 0.806 . . . . 0.0 109.412 -175.339 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 6.0 p-10 -151.39 171.35 6.6 Favored Pre-proline 0 CA--C 1.549 0.929 0 CA-C-N 114.681 -1.145 . . . . 0.0 109.349 -172.519 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 25.7 Cg_exo -65.34 -130.59 0.0 OUTLIER 'Trans proline' 0 C--N 1.382 2.325 0 C-N-CA 122.438 2.092 . . . . 0.0 112.61 169.731 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . 91.47 -58.27 3.05 Favored Glycine 0 C--N 1.348 1.209 0 O-C-N 121.353 -0.842 . . . . 0.0 114.375 -175.233 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 24.3 tpp180 -62.25 -44.57 96.25 Favored 'General case' 0 N--CA 1.484 1.265 0 N-CA-C 113.121 0.786 . . . . 0.0 113.121 -170.424 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 44.9 tt0 -65.47 -44.11 88.19 Favored 'General case' 0 N--CA 1.476 0.836 0 O-C-N 123.194 0.308 . . . . 0.0 110.517 -178.058 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -66.05 -32.06 81.31 Favored Glycine 0 C--N 1.342 0.865 0 O-C-N 123.5 0.5 . . . . 0.0 113.369 174.891 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 52.3 t-80 -65.58 -45.28 83.87 Favored 'General case' 0 N--CA 1.477 0.888 0 CA-C-O 121.439 0.638 . . . . 0.0 109.403 176.099 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.599 HD12 HG21 ' A' ' 54' ' ' VAL . 2.3 tm? -67.4 -37.63 83.4 Favored 'General case' 0 CA--C 1.542 0.653 0 CA-C-N 113.943 -1.481 . . . . 0.0 111.404 179.363 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . . . . . . . . . 38.9 tt0 -65.18 -43.19 92.48 Favored 'General case' 0 CA--C 1.54 0.59 0 C-N-CA 124.015 0.926 . . . . 0.0 110.709 176.923 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 12.8 mm-40 -66.9 -34.42 77.74 Favored 'General case' 0 N--CA 1.476 0.874 0 CA-C-N 115.861 -0.609 . . . . 0.0 110.753 175.458 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.524 ' O ' HG23 ' A' ' 27' ' ' VAL . 0.6 OUTLIER -59.48 -52.7 64.47 Favored 'General case' 0 N--CA 1.475 0.798 0 C-N-CA 123.234 0.614 . . . . 0.0 110.791 174.185 . . . . . . . . 3 3 . 1 . 019 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.475 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 85.3 mt -55.57 -48.81 77.01 Favored 'Isoleucine or valine' 0 N--CA 1.479 0.981 0 O-C-N 124.251 0.969 . . . . 0.0 110.449 -178.567 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.571 HD21 ' HB3' ' A' ' 63' ' ' LYS . 89.0 mt -62.56 -37.14 84.99 Favored 'General case' 0 N--CA 1.475 0.792 0 C-N-CA 123.217 0.607 . . . . 0.0 111.568 -178.838 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 56.7 tp60 -66.74 -47.92 70.77 Favored 'General case' 0 N--CA 1.472 0.649 0 O-C-N 123.743 0.652 . . . . 0.0 110.465 -179.327 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.524 HG23 ' O ' ' A' ' 23' ' ' ARG . 85.2 t -56.79 -40.49 71.1 Favored 'Isoleucine or valine' 0 CA--C 1.55 0.963 0 C-N-CA 124.153 0.981 . . . . 0.0 110.885 178.129 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.475 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 93.4 mt -69.47 -38.82 77.88 Favored 'General case' 0 CA--C 1.546 0.808 0 CA-C-N 114.769 -1.105 . . . . 0.0 112.069 178.662 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 89.2 m -69.37 -45.97 68.07 Favored 'General case' 0 N--CA 1.479 0.987 0 C-N-CA 123.546 0.738 . . . . 0.0 111.677 -178.619 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 36.5 mt-10 -68.88 -34.83 76.08 Favored 'General case' 0 N--CA 1.479 0.977 0 C-N-CA 123.437 0.695 . . . . 0.0 110.613 -176.796 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -67.29 -42.76 83.23 Favored 'General case' 0 C--O 1.238 0.475 0 CA-C-N 115.653 -0.703 . . . . 0.0 110.7 171.161 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 60.7 28.89 68.76 Favored Glycine 0 C--N 1.352 1.429 0 O-C-N 123.946 0.779 . . . . 0.0 111.853 -171.024 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 44.5 t -162.19 147.51 10.13 Favored Pre-proline 0 CA--C 1.55 0.953 0 C-N-CA 124.41 1.084 . . . . 0.0 109.057 -165.754 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . 0.401 ' HG3' ' HB2' ' A' ' 73' ' ' CYS . 74.3 Cg_exo -51.86 114.77 1.75 Allowed 'Trans proline' 0 C--N 1.37 1.708 0 C-N-CA 123.163 2.575 . . . . 0.0 113.757 174.79 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . 0.403 HG21 HG12 ' A' ' 27' ' ' VAL . 90.1 t -96.37 146.75 6.83 Favored 'Isoleucine or valine' 0 N--CA 1.478 0.954 0 C-N-CA 124.056 0.942 . . . . 0.0 109.691 179.214 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.6 mttp -82.01 152.56 26.62 Favored 'General case' 0 CA--C 1.539 0.543 0 C-N-CA 123.389 0.676 . . . . 0.0 110.505 179.684 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.45 ' HA ' HD12 ' A' ' 40' ' ' LEU . 39.1 tp -57.61 -49.46 76.35 Favored 'General case' 0 CA--C 1.545 0.756 0 C-N-CA 124.517 1.127 . . . . 0.0 111.053 178.928 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -52.66 -32.58 42.9 Favored 'General case' 0 CA--C 1.55 0.957 0 N-CA-C 114.036 1.124 . . . . 0.0 114.036 174.168 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 18.2 tt0 -83.88 -27.48 28.62 Favored 'General case' 0 N--CA 1.478 0.932 0 CA-C-O 120.959 0.409 . . . . 0.0 110.199 -179.846 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . 0.45 HD12 ' HA ' ' A' ' 37' ' ' LEU . 91.6 mt -65.64 -28.65 69.26 Favored 'General case' 0 CA--C 1.548 0.891 0 C-N-CA 123.581 0.753 . . . . 0.0 110.504 174.061 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.582 ' HA ' HD11 ' A' ' 51' ' ' LEU . 91.8 t -56.21 -52.3 52.74 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.455 0 C-N-CA 123.004 0.522 . . . . 0.0 111.926 -178.565 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 62.0 pttt -71.5 -50.73 28.65 Favored 'General case' 0 CA--C 1.547 0.846 0 O-C-N 123.561 0.538 . . . . 0.0 111.166 -176.767 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 44.6 mt-10 -70.9 -49.38 46.44 Favored 'General case' 0 C--N 1.355 0.84 0 C-N-CA 123.492 0.717 . . . . 0.0 111.391 -172.777 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . 0.489 ' HA ' ' HB3' ' A' ' 23' ' ' ARG . 54.6 m -76.46 -11.7 59.92 Favored 'General case' 0 N--CA 1.473 0.688 0 C-N-CA 122.511 0.324 . . . . 0.0 111.276 -179.231 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 96.3 mt-30 62.85 51.3 3.01 Favored 'General case' 0 N--CA 1.482 1.172 0 C-N-CA 124.266 1.026 . . . . 0.0 111.644 170.987 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -149.74 152.06 33.97 Favored Pre-proline 0 N--CA 1.47 0.56 0 C-N-CA 123.007 0.523 . . . . 0.0 110.652 -179.18 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 35.6 Cg_exo -62.83 145.92 94.85 Favored 'Trans proline' 0 C--N 1.366 1.5 0 C-N-CA 122.496 2.131 . . . . 0.0 111.727 173.127 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . . . . . . . . . 4.6 ttmp? -39.44 -56.58 1.58 Allowed 'General case' 0 N--CA 1.482 1.164 0 C-N-CA 124.87 1.268 . . . . 0.0 113.735 177.6 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 44.9 mtm180 -58.11 -36.37 72.8 Favored 'General case' 0 N--CA 1.488 1.436 0 N-CA-C 112.879 0.696 . . . . 0.0 112.879 -177.611 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 6.5 tp10 -64.94 -48.3 74.57 Favored 'General case' 0 C--O 1.245 0.853 0 O-C-N 123.54 0.525 . . . . 0.0 109.978 178.305 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.582 HD11 ' HA ' ' A' ' 41' ' ' VAL . 57.3 mt -55.35 -53.25 58.49 Favored 'General case' 0 C--O 1.211 -0.923 0 O-C-N 124.521 1.138 . . . . 0.0 111.52 178.09 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 17.3 m120 -49.76 -50.1 45.82 Favored 'General case' 0 N--CA 1.488 1.461 0 O-C-N 124.383 1.052 . . . . 0.0 112.285 -179.311 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 5.9 tp-100 -56.79 -46.52 81.5 Favored 'General case' 0 CA--C 1.546 0.791 0 O-C-N 124.313 1.008 . . . . 0.0 111.067 -178.576 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.599 HG21 HD12 ' A' ' 20' ' ' LEU . 54.0 t -70.32 -43.16 78.67 Favored 'Isoleucine or valine' 0 CA--C 1.551 1.004 0 C-N-CA 122.877 0.471 . . . . 0.0 110.835 179.922 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . 0.407 HD13 ' NE1' ' A' ' 72' ' ' TRP . 60.8 mt -51.9 -49.67 62.57 Favored 'General case' 0 N--CA 1.486 1.372 0 C-N-CA 125.03 1.332 . . . . 0.0 114.078 179.621 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 84.2 m-85 -71.69 -26.31 62.46 Favored 'General case' 0 N--CA 1.479 0.99 0 CA-C-N 118.08 0.4 . . . . 0.0 110.927 -178.245 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . 0.417 ' O ' ' HG2' ' A' ' 61' ' ' GLU . 3.8 tmt_? -68.43 -52.28 34.52 Favored 'General case' 0 CA--C 1.538 0.482 0 C-N-CA 123.479 0.711 . . . . 0.0 109.431 174.462 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.504 ' SD ' HG12 ' A' ' 54' ' ' VAL . 83.3 mtp -61.11 -29.25 69.65 Favored 'General case' 0 N--CA 1.477 0.902 0 C-N-CA 124.695 1.198 . . . . 0.0 111.498 178.549 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 76.1 tttt -63.78 -41.96 97.86 Favored 'General case' 0 N--CA 1.47 0.567 0 C-N-CA 122.944 0.497 . . . . 0.0 110.575 175.604 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 24.5 ttmm -71.49 -28.55 64.0 Favored 'General case' 0 CA--C 1.548 0.899 0 O-C-N 123.83 0.706 . . . . 0.0 110.758 175.981 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . 0.417 ' HG2' ' O ' ' A' ' 57' ' ' ARG . 8.6 mm-40 -80.01 -2.65 45.08 Favored 'General case' 0 N--CA 1.48 1.047 0 C-N-CA 123.125 0.57 . . . . 0.0 110.921 173.201 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 74.4 mt 63.88 16.11 9.6 Favored 'General case' 0 N--CA 1.489 1.48 0 C-N-CA 125.036 1.334 . . . . 0.0 112.115 178.62 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.571 ' HB3' HD21 ' A' ' 25' ' ' LEU . 96.9 mttt -77.06 -32.46 56.85 Favored 'General case' 0 N--CA 1.477 0.894 0 C-N-CA 124.257 1.023 . . . . 0.0 110.637 176.43 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.405 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 22.0 m -129.51 164.18 32.77 Favored 'Isoleucine or valine' 0 N--CA 1.477 0.905 0 N-CA-C 109.468 -0.567 . . . . 0.0 109.468 176.362 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 26.7 t -137.11 148.25 46.56 Favored 'General case' 0 N--CA 1.468 0.452 0 N-CA-C 108.226 -1.028 . . . . 0.0 108.226 178.53 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . . . . . . . . . 45.0 tp -100.57 106.58 18.1 Favored 'General case' 0 N--CA 1.477 0.921 0 N-CA-C 108.603 -0.888 . . . . 0.0 108.603 179.716 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 11.6 p -88.18 -43.97 11.23 Favored 'General case' 0 CA--C 1.546 0.802 0 C-N-CA 123.902 0.881 . . . . 0.0 111.063 -176.869 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . . . . . . . . . 34.3 t -140.73 153.71 68.14 Favored Pre-proline 0 N--CA 1.481 1.115 0 N-CA-C 107.357 -1.349 . . . . 0.0 107.357 -177.135 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . . . . . . . . . 74.8 Cg_exo -46.02 112.75 0.48 Allowed 'Trans proline' 0 C--N 1.386 2.528 0 C-N-CA 123.235 2.623 . . . . 0.0 114.608 -179.418 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . 68.73 20.41 8.17 Favored 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 124.856 1.262 . . . . 0.0 112.075 -179.834 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . . . . . . . . . 6.2 m -126.04 115.48 19.93 Favored 'General case' 0 C--O 1.241 0.645 0 N-CA-C 107.993 -1.114 . . . . 0.0 107.993 -177.713 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . 0.407 ' NE1' HD13 ' A' ' 55' ' ' LEU . 82.5 m95 -115.99 142.98 46.08 Favored 'General case' 0 N--CA 1.467 0.38 0 C-N-CA 123.712 0.805 . . . . 0.0 109.797 -167.704 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . 0.401 ' HB2' ' HG3' ' A' ' 34' ' ' PRO . 53.4 t -113.94 161.47 17.6 Favored 'General case' 0 C--O 1.242 0.709 0 C-N-CA 123.223 0.609 . . . . 0.0 110.213 177.712 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 52.1 tp -66.58 102.38 0.9 Allowed 'General case' 0 CA--C 1.541 0.611 0 N-CA-C 109.025 -0.732 . . . . 0.0 109.025 176.511 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.405 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . -79.08 -35.2 31.17 Favored Glycine 0 C--N 1.343 0.924 0 CA-C-N 115.855 -0.611 . . . . 0.0 111.647 -178.589 . . . . . . . . 2 2 . 1 . 019 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -87.74 46.95 3.51 Favored Glycine 0 C--N 1.347 1.167 0 N-CA-C 111.561 -0.615 . . . . 0.0 111.561 176.307 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 2.5 t -79.99 89.2 5.33 Favored 'General case' 0 N--CA 1.469 0.512 0 C-N-CA 123.926 0.89 . . . . 0.0 109.93 -179.407 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 5.7 m-20 50.37 69.52 2.57 Favored Pre-proline 0 N--CA 1.478 0.948 0 CA-C-N 114.621 -1.172 . . . . 0.0 111.151 -178.147 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 53.6 Cg_exo -54.88 -52.44 8.0 Favored 'Trans proline' 0 C--N 1.374 1.886 0 C-N-CA 123.576 2.851 . . . . 0.0 112.608 -174.476 . . . . . . . . 1 1 . 1 . 019 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 39.9 tt0 . . . . . 0 C--O 1.252 1.19 0 O-C-N 124.294 0.996 . . . . 0.0 108.812 177.872 . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 1' ' ' MET . . . . . . . . . . . . . 15.8 tpt . . . . . 0 N--CA 1.481 1.082 0 N-CA-C 109.327 -0.62 . . . . 0.0 109.327 . . . . . . . . . 0 0 . 1 . 020 nuclear nobuild full ' A' A ' 2' ' ' GLY . . . . . . . . . . . . . . . -76.53 175.36 53.21 Favored Glycine 0 CA--C 1.528 0.891 0 O-C-N 123.46 0.475 . . . . 0.0 112.763 177.091 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 3' ' ' HIS . . . . . . . . . . . . . 12.3 m170 63.54 -84.62 0.02 OUTLIER 'General case' 0 N--CA 1.478 0.951 0 C-N-CA 124.789 1.235 . . . . 0.0 110.931 -179.87 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 4' ' ' HIS . . . . . . . . . . . . . 18.4 p80 -90.47 69.91 6.9 Favored 'General case' 0 CA--C 1.544 0.713 0 CA-C-O 121.982 0.896 . . . . 0.0 109.759 178.186 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 5' ' ' HIS . . . . . . . . . . . . . 24.9 p80 -85.2 54.75 3.21 Favored 'General case' 0 CA--C 1.552 1.031 0 CA-C-N 114.65 -1.159 . . . . 0.0 109.424 176.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 6' ' ' HIS . . . . . . . . . . . . . 42.6 p-80 -68.99 -35.39 76.65 Favored 'General case' 0 CA--C 1.553 1.082 0 C-N-CA 124.464 1.106 . . . . 0.0 111.787 -170.373 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 7' ' ' HIS . . . . . . . . . . . . . 26.1 p-80 49.53 -66.46 0.0 OUTLIER 'General case' 0 N--CA 1.498 1.933 0 C-N-CA 127.093 2.157 . . . . 0.0 114.929 -176.177 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 8' ' ' HIS . . . . . . . . . . . . . 33.3 t-80 74.29 -16.5 0.53 Allowed 'General case' 0 N--CA 1.489 1.476 0 C-N-CA 125.38 1.472 . . . . 0.0 114.439 167.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 9' ' ' SER . . . . . . . . . . . . . 13.4 m -88.39 72.09 8.95 Favored 'General case' 0 N--CA 1.479 1.014 0 CA-C-N 118.499 0.59 . . . . 0.0 110.091 -177.013 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 10' ' ' HIS . . . . . . . . . . . . . 70.3 m-70 -86.94 74.02 9.82 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.556 0.743 . . . . 0.0 109.975 179.805 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 11' ' ' MET . . . . . . . . . . . . . 23.6 mmt 70.51 -68.33 0.21 Allowed 'General case' 0 N--CA 1.483 1.208 0 C-N-CA 126.071 1.748 . . . . 0.0 111.234 -177.923 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 12' ' ' ALA . . . . . . . . . . . . . . . -166.57 -172.31 2.13 Favored 'General case' 0 N--CA 1.479 1.015 0 C-N-CA 124.776 1.23 . . . . 0.0 109.443 178.342 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 13' ' ' ASP . . . . . . . . . . . . . 9.6 m-20 72.71 141.35 0.08 OUTLIER Pre-proline 0 N--CA 1.487 1.398 0 C-N-CA 124.996 1.318 . . . . 0.0 113.45 168.961 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 14' ' ' PRO . . . . . . . . . . . . . 37.2 Cg_endo -89.21 16.29 1.83 Allowed 'Trans proline' 0 C--N 1.378 2.127 0 C-N-CA 123.397 2.731 . . . . 0.0 113.348 175.487 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 15' ' ' GLY . . . . . . . . . . . . . . . -47.47 -27.87 4.47 Favored Glycine 0 C--N 1.353 1.514 0 N-CA-C 115.411 0.925 . . . . 0.0 115.411 175.268 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 16' ' ' ARG . . . . . . . . . . . . . 19.0 ttm-85 -61.65 -33.59 74.22 Favored 'General case' 0 C--N 1.362 1.113 0 C-N-CA 123.733 0.813 . . . . 0.0 111.643 177.739 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 17' ' ' GLU . . . . . . . . . . . . . 46.6 mt-10 -55.43 -44.65 76.48 Favored 'General case' 0 N--CA 1.483 1.18 0 C-N-CA 122.674 0.39 . . . . 0.0 110.852 176.659 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 18' ' ' GLY . . . . . . . . . . . . . . . -72.62 -32.82 61.29 Favored Glycine 0 C--N 1.347 1.174 0 O-C-N 124.262 0.976 . . . . 0.0 114.275 179.082 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 19' ' ' HIS . . . . . . . . . . . . . 37.8 m80 -67.47 -51.97 44.91 Favored 'General case' 0 N--CA 1.481 1.109 0 C-N-CA 122.818 0.447 . . . . 0.0 110.555 176.155 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 20' ' ' LEU . . . . . 0.575 HD11 HD23 ' A' ' 51' ' ' LEU . 2.7 tm? -63.44 -37.18 86.29 Favored 'General case' 0 CA--C 1.547 0.845 0 C-N-CA 124.996 1.319 . . . . 0.0 110.652 178.525 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 21' ' ' GLU . . . . . 0.749 ' HG3' ' SD ' ' A' ' 58' ' ' MET . 29.3 tt0 -56.56 -48.72 76.73 Favored 'General case' 0 N--CA 1.486 1.341 0 C-N-CA 124.537 1.135 . . . . 0.0 110.305 171.235 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 22' ' ' GLN . . . . . . . . . . . . . 6.8 tp-100 -62.84 -38.88 92.54 Favored 'General case' 0 C--O 1.239 0.551 0 CA-C-N 114.602 -1.181 . . . . 0.0 110.152 -177.338 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 23' ' ' ARG . . . . . 0.504 ' O ' HG23 ' A' ' 27' ' ' VAL . 26.8 mmt180 -64.96 -51.91 59.18 Favored 'General case' 0 C--N 1.351 0.632 0 C-N-CA 122.764 0.425 . . . . 0.0 111.477 178.661 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 24' ' ' ILE . . . . . 0.47 ' O ' ' HG ' ' A' ' 28' ' ' LEU . 61.6 mt -57.35 -47.85 83.76 Favored 'Isoleucine or valine' 0 N--CA 1.481 1.112 0 O-C-N 123.865 0.728 . . . . 0.0 110.514 -178.685 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 25' ' ' LEU . . . . . 0.458 HD21 ' HB3' ' A' ' 63' ' ' LYS . 94.3 mt -65.55 -32.95 74.81 Favored 'General case' 0 N--CA 1.473 0.691 0 C-N-CA 123.189 0.596 . . . . 0.0 111.422 -176.189 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 26' ' ' GLN . . . . . . . . . . . . . 9.2 tt0 -69.94 -43.02 72.44 Favored 'General case' 0 CA--C 1.547 0.827 0 O-C-N 123.497 0.498 . . . . 0.0 110.102 177.569 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 27' ' ' VAL . . . . . 0.504 HG23 ' O ' ' A' ' 23' ' ' ARG . 87.8 t -56.57 -43.5 78.62 Favored 'Isoleucine or valine' 0 N--CA 1.488 1.459 0 C-N-CA 123.684 0.794 . . . . 0.0 110.748 176.641 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 28' ' ' LEU . . . . . 0.47 ' HG ' ' O ' ' A' ' 24' ' ' ILE . 79.9 mt -66.56 -42.82 86.52 Favored 'General case' 0 N--CA 1.478 0.96 0 CA-C-N 114.958 -1.019 . . . . 0.0 111.293 179.889 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 29' ' ' THR . . . . . . . . . . . . . 55.5 m -72.85 -38.17 67.17 Favored 'General case' 0 CA--C 1.546 0.796 0 C-N-CA 124.187 0.995 . . . . 0.0 111.91 -175.299 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 30' ' ' GLU . . . . . . . . . . . . . 50.1 mt-10 -69.51 -42.65 74.43 Favored 'General case' 0 N--CA 1.479 1.004 0 C-N-CA 122.751 0.42 . . . . 0.0 110.644 178.835 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 31' ' ' ALA . . . . . . . . . . . . . . . -66.99 -36.94 83.28 Favored 'General case' 0 C--O 1.24 0.584 0 O-C-N 123.722 0.639 . . . . 0.0 110.862 177.596 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 32' ' ' GLY . . . . . . . . . . . . . . . 59.11 34.12 77.93 Favored Glycine 0 C--N 1.353 1.513 0 O-C-N 124.155 0.909 . . . . 0.0 112.508 -174.81 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 33' ' ' SER . . . . . . . . . . . . . 34.9 t -164.29 151.56 10.25 Favored Pre-proline 0 CA--C 1.554 1.105 0 C-N-CA 124.459 1.104 . . . . 0.0 108.615 -166.949 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 34' ' ' PRO . . . . . . . . . . . . . 13.0 Cg_endo -54.59 118.87 5.56 Favored 'Trans proline' 0 C--N 1.375 1.96 0 C-N-CA 123.366 2.711 . . . . 0.0 112.607 175.919 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 35' ' ' VAL . . . . . . . . . . . . . 46.6 t -102.96 127.58 56.63 Favored 'Isoleucine or valine' 0 N--CA 1.471 0.58 0 N-CA-C 108.487 -0.931 . . . . 0.0 108.487 179.05 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 36' ' ' LYS . . . . . . . . . . . . . 59.1 mttp -68.95 150.49 47.66 Favored 'General case' 0 N--CA 1.47 0.568 0 C-N-CA 123.421 0.689 . . . . 0.0 110.709 -178.253 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 37' ' ' LEU . . . . . 0.531 HD21 ' HG3' ' A' ' 48' ' ' LYS . 57.6 tp -58.58 -46.78 86.21 Favored 'General case' 0 N--CA 1.476 0.871 0 C-N-CA 124.076 0.95 . . . . 0.0 111.373 -179.431 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 38' ' ' ALA . . . . . . . . . . . . . . . -51.86 -35.93 46.67 Favored 'General case' 0 N--CA 1.474 0.761 0 C-N-CA 123.937 0.895 . . . . 0.0 113.269 171.328 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 39' ' ' GLN . . . . . . . . . . . . . 1.0 OUTLIER -78.33 -34.13 48.78 Favored 'General case' 0 CA--C 1.556 1.186 0 N-CA-C 109.778 -0.453 . . . . 0.0 109.778 177.182 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 40' ' ' LEU . . . . . . . . . . . . . 88.9 mt -64.18 -33.42 75.74 Favored 'General case' 0 N--CA 1.485 1.303 0 C-N-CA 123.954 0.902 . . . . 0.0 110.728 177.649 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 41' ' ' VAL . . . . . 0.582 ' HA ' HD11 ' A' ' 51' ' ' LEU . 83.4 t -58.91 -47.74 88.65 Favored 'Isoleucine or valine' 0 N--CA 1.482 1.156 0 C-N-CA 123.318 0.647 . . . . 0.0 110.259 175.332 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 42' ' ' LYS . . . . . . . . . . . . . 39.4 ttpt -67.4 -54.04 23.94 Favored 'General case' 0 CA--C 1.543 0.676 0 CA-C-N 115.176 -0.92 . . . . 0.0 111.28 -179.568 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 43' ' ' GLU . . . . . . . . . . . . . 19.9 mm-40 -70.29 -48.95 54.36 Favored 'General case' 0 N--CA 1.472 0.659 0 C-N-CA 123.803 0.841 . . . . 0.0 112.867 -171.703 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 44' ' ' CYS . . . . . . . . . . . . . 44.3 m -77.31 -16.06 59.12 Favored 'General case' 0 N--CA 1.48 1.03 0 N-CA-C 110.312 -0.255 . . . . 0.0 110.312 179.872 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 45' ' ' GLN . . . . . . . . . . . . . 47.4 mt-30 62.74 56.28 1.96 Allowed 'General case' 0 C--N 1.364 1.215 0 C-N-CA 124.295 1.038 . . . . 0.0 110.574 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 46' ' ' ALA . . . . . . . . . . . . . . . -148.43 151.32 36.29 Favored Pre-proline 0 N--CA 1.475 0.777 0 CA-C-N 114.794 -1.093 . . . . 0.0 111.105 -173.626 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 47' ' ' PRO . . . . . . . . . . . . . 38.9 Cg_exo -59.54 137.61 78.74 Favored 'Trans proline' 0 C--N 1.378 2.121 0 C-N-CA 122.834 2.356 . . . . 0.0 111.969 172.882 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 48' ' ' LYS . . . . . 0.531 ' HG3' HD21 ' A' ' 37' ' ' LEU . 22.7 ttmm -35.1 -48.35 0.42 Allowed 'General case' 0 N--CA 1.488 1.456 0 C-N-CA 125.595 1.558 . . . . 0.0 112.945 169.741 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 49' ' ' ARG . . . . . . . . . . . . . 37.1 ttm180 -61.33 -48.34 81.8 Favored 'General case' 0 CA--C 1.545 0.788 0 C-N-CA 124.663 1.185 . . . . 0.0 111.82 -178.912 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 50' ' ' GLU . . . . . . . . . . . . . 27.0 tt0 -62.9 -46.72 86.48 Favored 'General case' 0 N--CA 1.48 1.04 0 C-N-CA 123.287 0.635 . . . . 0.0 110.164 -178.971 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 51' ' ' LEU . . . . . 0.582 HD11 ' HA ' ' A' ' 41' ' ' VAL . 83.6 mt -52.79 -53.71 44.43 Favored 'General case' 0 C--O 1.206 -1.204 0 O-C-N 124.353 1.033 . . . . 0.0 110.735 174.434 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 52' ' ' ASN . . . . . . . . . . . . . 8.5 m120 -59.21 -46.37 88.64 Favored 'General case' 0 N--CA 1.477 0.887 0 O-C-N 124.582 1.177 . . . . 0.0 112.766 -175.58 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 53' ' ' GLN . . . . . . . . . . . . . 93.2 mt-30 -54.61 -43.21 72.0 Favored 'General case' 0 N--CA 1.476 0.87 0 O-C-N 123.428 0.455 . . . . 0.0 111.254 176.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 54' ' ' VAL . . . . . 0.458 HG21 HD12 ' A' ' 20' ' ' LEU . 50.7 t -72.79 -39.35 59.45 Favored 'Isoleucine or valine' 0 CA--C 1.554 1.119 0 CA-C-O 119.266 -0.397 . . . . 0.0 110.987 176.821 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 55' ' ' LEU . . . . . . . . . . . . . 44.3 mt -58.2 -53.88 53.24 Favored 'General case' 0 N--CA 1.487 1.391 0 C-N-CA 124.781 1.232 . . . . 0.0 114.232 -178.471 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 56' ' ' TYR . . . . . . . . . . . . . 95.2 m-85 -69.84 -26.31 64.16 Favored 'General case' 0 N--CA 1.487 1.384 0 CA-C-N 119.557 1.071 . . . . 0.0 110.49 -176.733 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 57' ' ' ARG . . . . . . . . . . . . . 43.2 ttt-85 -65.03 -53.26 48.81 Favored 'General case' 0 CA--C 1.544 0.725 0 C-N-CA 124.037 0.935 . . . . 0.0 109.387 171.722 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 58' ' ' MET . . . . . 0.749 ' SD ' ' HG3' ' A' ' 21' ' ' GLU . 73.3 mtm -64.04 -26.92 68.78 Favored 'General case' 0 N--CA 1.473 0.683 0 C-N-CA 124.51 1.124 . . . . 0.0 111.906 179.749 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 59' ' ' LYS . . . . . . . . . . . . . 57.9 tttm -66.86 -41.1 87.86 Favored 'General case' 0 CA--C 1.539 0.534 0 C-N-CA 123.564 0.746 . . . . 0.0 110.347 176.768 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 60' ' ' LYS . . . . . . . . . . . . . 40.7 ttmt -63.45 -40.33 96.85 Favored 'General case' 0 C--N 1.354 0.799 0 C-N-CA 123.477 0.711 . . . . 0.0 109.939 172.216 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 61' ' ' GLU . . . . . . . . . . . . . 42.4 mt-10 -77.77 0.65 22.9 Favored 'General case' 0 CA--C 1.554 1.12 0 C-N-CA 123.852 0.861 . . . . 0.0 111.944 178.694 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 62' ' ' LEU . . . . . . . . . . . . . 84.8 mt 67.96 10.45 7.81 Favored 'General case' 0 N--CA 1.494 1.728 0 C-N-CA 125.881 1.672 . . . . 0.0 113.298 174.656 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 63' ' ' LYS . . . . . 0.566 ' HB2' ' HB3' ' A' ' 58' ' ' MET . 55.0 mttm -69.24 -44.12 72.61 Favored 'General case' 0 CA--C 1.543 0.688 0 C-N-CA 124.479 1.112 . . . . 0.0 110.533 177.732 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 64' ' ' VAL . . . . . 0.436 ' HA ' ' H ' ' A' ' 75' ' ' GLY . 26.8 m -123.32 164.41 21.01 Favored 'Isoleucine or valine' 0 N--CA 1.483 1.189 0 C-N-CA 123.657 0.783 . . . . 0.0 109.778 -178.472 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 65' ' ' SER . . . . . . . . . . . . . 33.2 t -147.03 157.64 43.68 Favored 'General case' 0 N--CA 1.469 0.514 0 C-N-CA 123.723 0.809 . . . . 0.0 109.034 175.65 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 66' ' ' LEU . . . . . 0.403 HD12 ' O ' ' A' ' 71' ' ' THR . 30.8 tp -101.5 106.89 18.05 Favored 'General case' 0 CA--C 1.542 0.67 0 N-CA-C 108.296 -1.001 . . . . 0.0 108.296 -178.187 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 67' ' ' THR . . . . . . . . . . . . . 22.2 p -86.08 -40.39 15.77 Favored 'General case' 0 N--CA 1.478 0.933 0 C-N-CA 123.237 0.615 . . . . 0.0 110.748 -176.402 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 68' ' ' SER . . . . . 0.437 ' HB2' ' HD2' ' A' ' 69' ' ' PRO . 16.0 p -142.21 160.65 54.15 Favored Pre-proline 0 CA--C 1.558 1.285 0 CA-C-O 117.753 -1.118 . . . . 0.0 108.357 178.367 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 69' ' ' PRO . . . . . 0.437 ' HD2' ' HB2' ' A' ' 68' ' ' SER . 37.2 Cg_exo -22.97 -70.94 0.03 OUTLIER 'Trans proline' 0 C--N 1.393 2.892 1 C-N-CA 126.099 4.533 . . . . 0.0 117.79 -168.426 . . . . . . . . 3 3 . 1 . 020 nuclear nobuild full ' A' A ' 70' ' ' ALA . . . . . . . . . . . . . . . -116.34 42.08 2.49 Favored 'General case' 0 N--CA 1.485 1.276 0 C-N-CA 123.637 0.775 . . . . 0.0 110.506 178.837 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 71' ' ' THR . . . . . 0.403 ' O ' HD12 ' A' ' 66' ' ' LEU . 59.3 m -130.16 125.95 36.28 Favored 'General case' 0 N--CA 1.475 0.789 0 C-N-CA 123.677 0.791 . . . . 0.0 109.92 -177.747 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 72' ' ' TRP . . . . . . . . . . . . . 83.9 m95 -115.5 136.06 53.46 Favored 'General case' 0 N--CA 1.463 0.197 0 C-N-CA 123.652 0.781 . . . . 0.0 109.259 -174.198 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 73' ' ' CYS . . . . . . . . . . . . . 32.3 t -118.31 171.52 8.08 Favored 'General case' 0 C--O 1.245 0.837 0 N-CA-C 109.059 -0.719 . . . . 0.0 109.059 175.663 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 74' ' ' LEU . . . . . . . . . . . . . 38.0 tp -68.83 104.75 2.13 Favored 'General case' 0 CA--C 1.541 0.628 0 N-CA-C 108.167 -1.049 . . . . 0.0 108.167 173.079 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 75' ' ' GLY . . . . . 0.436 ' H ' ' HA ' ' A' ' 64' ' ' VAL . . . -69.01 -52.05 25.59 Favored Glycine 0 C--N 1.348 1.215 0 O-C-N 123.946 0.779 . . . . 0.0 111.379 -178.212 . . . . . . . . 2 2 . 1 . 020 nuclear nobuild full ' A' A ' 76' ' ' GLY . . . . . . . . . . . . . . . -84.65 -155.42 23.07 Favored Glycine 0 C--N 1.342 0.868 0 CA-C-N 114.854 -0.673 . . . . 0.0 112.128 173.954 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 77' ' ' THR . . . . . . . . . . . . . 9.3 t -169.1 165.98 11.01 Favored 'General case' 0 C--O 1.235 0.325 0 C-N-CA 123.205 0.602 . . . . 0.0 110.348 -179.295 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 78' ' ' ASP . . . . . . . . . . . . . 3.8 m-20 -131.71 128.05 21.59 Favored Pre-proline 0 N--CA 1.471 0.608 0 C-N-CA 123.835 0.854 . . . . 0.0 108.875 176.207 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 79' ' ' PRO . . . . . . . . . . . . . 13.7 Cg_exo -70.4 79.3 1.15 Allowed 'Trans proline' 0 C--N 1.375 1.936 0 C-N-CA 123.136 2.557 . . . . 0.0 111.913 176.368 . . . . . . . . 1 1 . 1 . 020 nuclear nobuild full ' A' A ' 80' ' ' GLU . . . . . . . . . . . . . 0.6 OUTLIER . . . . . 0 C--O 1.247 0.944 0 N-CA-C 106.503 -1.665 . . . . 0.0 106.503 -179.26 . . . . . . . . 1 1 . 1 stop_ save_